小分子和化合物库

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显示第112个,产品总数227

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  1. 阿扎佩隆
      规格或纯度 :
    • ≥99%
    CAS号 : 1649-18-9        Compound CID : 15443
    分子式: C19H22FN3O        分子量: 327.4
    IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one
    SMILES: C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=N3
    InChIKey: XTKDAFGWCDAMPY-UHFFFAOYSA-N
    InChI: InChI=1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
  2. XL335
      规格或纯度 :
    • ≥98%
    CAS号 : 629664-81-9        Compound CID : 10026128
    分子式: C25H24F2N2O3        分子量: 438.48
    IUPAC Name: propan-2-yl 3-(3,4-difluorobenzoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate
    SMILES: CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)C4=CC(=C(C=C4)F)F
    InChIKey: INASOKQDNHHMRE-UHFFFAOYSA-N
    InChI: InChI=1S/C25H24F2N2O3/c1-14(2)32-24(31)17-12-29(23(30)15-9-10-18(26)19(27)11-15)13-25(3,4)21-16-7-5-6-8-20(16)28-22(17)21/h5-12,14,28H,13H2,1-4H3
  3. 布南色林
    CAS号 : 132810-10-7        Compound CID : 125564
    分子式: C23H30FN3        分子量: 367.5
    IUPAC Name: 2-(4-ethylpiperazin-1-yl)-4-(4-fluorophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine
    SMILES: CCN1CCN(CC1)C2=NC3=C(CCCCCC3)C(=C2)C4=CC=C(C=C4)F
    InChIKey: XVGOZDAJGBALKS-UHFFFAOYSA-N
    InChI: InChI=1S/C23H30FN3/c1-2-26-13-15-27(16-14-26)23-17-21(18-9-11-19(24)12-10-18)20-7-5-3-4-6-8-22(20)25-23/h9-12,17H,2-8,13-16H2,1H3
  4. 鹅去氧胆酸
    CAS号 : 474-25-9       
    分子式: C24H40O4        分子量: 392.58
    IUPAC Name: (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
    SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
    InChIKey: RUDATBOHQWOJDD-BSWAIDMHSA-N
    InChI: InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
  5. 卡维地洛
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 72956-09-3        Compound CID : 2585
    分子式: C24H26N2O4        分子量: 406.47
    IUPAC Name: 1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
    SMILES: COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O
    InChIKey: OGHNVEJMJSYVRP-UHFFFAOYSA-N
    InChI: InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3
  6. 盐酸氯丙嗪(CPZ)
    CAS号 : 69-09-0        Compound CID : 6240
    分子式: C17H19ClN2S·HCl        分子量: 355.33
    IUPAC Name: 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;hydrochloride
    SMILES: CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Cl
    InChIKey: FBSMERQALIEGJT-UHFFFAOYSA-N
    InChI: InChI=1S/C17H19ClN2S.ClH/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H
  7. 阿多拉嗪
      规格或纯度 :
    • ≥98%
    CAS号 : 222551-17-9        Compound CID : 9887537
    分子式: C24H24FN3O2        分子量: 405.46
    IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]piperazine
    SMILES: C1CN(CCN1CC2=CC(=CN=C2)C3=CC=C(C=C3)F)C4=C5C(=CC=C4)OCCO5
    InChIKey: IUVSEUFHPNITEQ-UHFFFAOYSA-N
    InChI: InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2
  8. 多巴胺
    CAS号 : 51-61-6        Compound CID : 681
    分子式: C8H11NO2        分子量: 153.18
    IUPAC Name: 4-(2-aminoethyl)benzene-1,2-diol
    SMILES: C1=CC(=C(C=C1CCN)O)O
    InChIKey: VYFYYTLLBUKUHU-UHFFFAOYSA-N
    InChI: InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
  9. 多巴胺
    CAS号 : 51-61-6        Compound CID : 681
    分子式: C8H11NO2        分子量: 153.18
    IUPAC Name: 4-(2-aminoethyl)benzene-1,2-diol
    SMILES: C1=CC(=C(C=C1CCN)O)O
    InChIKey: VYFYYTLLBUKUHU-UHFFFAOYSA-N
    InChI: InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
  10. 盐酸谭螺螺酮(Metanopirone)
      规格或纯度 :
    • ≥99%
    CAS号 : 99095-10-0        Compound CID : 13422623
    分子式: C21H29N5O2.HCl        分子量: 419.95
    IUPAC Name: (1S,2R,6S,7R)-4-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione;hydrochloride
    SMILES: C1CC2CC1C3C2C(=O)N(C3=O)CCCCN4CCN(CC4)C5=NC=CC=N5.Cl
    InChIKey: ACVFJYKNBOHIMH-DPFKZJTMSA-N
    InChI: InChI=1S/C21H29N5O2.ClH/c27-19-17-15-4-5-16(14-15)18(17)20(28)26(19)9-2-1-8-24-10-12-25(13-11-24)21-22-6-3-7-23-21;/h3,6-7,15-18H,1-2,4-5,8-14H2;1H/t15-,16+,17+,18-;
  11. SKF 82958 氢溴酸盐
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 74115-01-8        Compound CID : 9909521
    分子式: C19H20ClNO2.HBr        分子量: 410.73
    IUPAC Name: 9-chloro-5-phenyl-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol;hydrobromide
    SMILES: C=CCN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)O)O)Cl.Br
    InChIKey: WLXGFAVTAAQOFH-UHFFFAOYSA-N
    InChI: InChI=1S/C19H20ClNO2.BrH/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13;/h2-7,11,16,22-23H,1,8-10,12H2;1H
  12. LE 300,D1拮抗剂
      规格或纯度 :
    • ≥98%(HPLC)
    CAS号 : 274694-98-3        Compound CID : 4350931
    分子式: C20H22N2        分子量: 290.41
    IUPAC Name: 11-methyl-11,21-diazatetracyclo[12.7.0.03,8.015,20]henicosa-1(14),3,5,7,15,17,19-heptaene
    SMILES: CN1CCC2=CC=CC=C2CC3=C(CC1)C4=CC=CC=C4N3
    InChIKey: YEWGIGCYIAMFMA-UHFFFAOYSA-N
    InChI: InChI=1S/C20H22N2/c1-22-12-10-15-6-2-3-7-16(15)14-20-18(11-13-22)17-8-4-5-9-19(17)21-20/h2-9,21H,10-14H2,1H3
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