1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine

C169H185N19O28S16 — CID 161476741

IUPAC1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine
SMILESCCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.CN(C)S(=O)(=O)c1ccc(-c2csc(C/N=C/c3ccc(O)cc3)n2)cc1.CNc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Cc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1cccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)c1.Cc1ccccc1OCC(=O)Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Nc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1
InChIInChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C19H19N3O3S2.C15H19N3O2S2.C14H17N3O2S2/c1-2-19-6-10-22(11-7-19)31-17-21(28)16-25-26-24(18-32-25)20-8-12-23(13-9-20)33(29,30)27-14-4-3-5-15-27;27-20(23-15-30-21-6-2-3-7-22(21)31-23)14-24-25-19(16-32-24)17-8-10-18(11-9-17)33(28,29)26-12-4-1-5-13-26;1-18-7-3-4-8-23(18)30-16-20(27)15-24-25-22(17-31-24)19-9-11-21(12-10-19)32(28,29)26-13-5-2-6-14-26;1-18-5-9-21(10-6-18)30-16-20(27)15-24-25-23(17-31-24)19-7-11-22(12-8-19)32(28,29)26-13-3-2-4-14-26;1-18-6-5-7-21(14-18)30-16-20(27)15-24-25-23(17-31-24)19-8-10-22(11-9-19)32(28,29)26-12-3-2-4-13-26;1-22(2)27(24,25)17-9-5-15(6-10-17)18-13-26-19(21-18)12-20-11-14-3-7-16(23)8-4-14;1-16-15-17-14(11-21-15)12-5-7-13(8-6-12)22(19,20)18-9-3-2-4-10-18;15-14-16-13(10-20-14)11-4-6-12(7-5-11)21(18,19)17-8-2-1-3-9-17/h6-13,18H,2-5,14-17H2,1H3;2-3,6-11,16,23H,1,4-5,12-15H2;3-4,7-12,17H,2,5-6,13-16H2,1H3;5-12,17H,2-4,13-16H2,1H3;5-11,14,17H,2-4,12-13,15-16H2,1H3;3-11,13,23H,12H2,1-2H3;5-8,11H,2-4,9-10H2,1H3,(H,16,17);4-7,10H,1-3,8-9H2,(H2,15,16)/b;;;;;20-11+;;
InChIKeyWDUVKKRPYVHMRP-WVMCQOBTSA-N
MW3443.52 g/mol
LogP31.10
Rot. Bonds52

About 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine

1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine (PubChem CID 161476741) has the molecular formula C169H185N19O28S16 and a molecular weight of 3443.52 g/mol. Its IUPAC name is 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine
PubChem CID161476741
Molecular FormulaC169H185N19O28S16
Molecular Weight3443.52 g/mol
Exact Mass3439.92
IUPAC Name1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine
SMILESCCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.CN(C)S(=O)(=O)c1ccc(-c2csc(C/N=C/c3ccc(O)cc3)n2)cc1.CNc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Cc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1cccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)c1.Cc1ccccc1OCC(=O)Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Nc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1
InChIInChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C19H19N3O3S2.C15H19N3O2S2.C14H17N3O2S2/c1-2-19-6-10-22(11-7-19)31-17-21(28)16-25-26-24(18-32-25)20-8-12-23(13-9-20)33(29,30)27-14-4-3-5-15-27;27-20(23-15-30-21-6-2-3-7-22(21)31-23)14-24-25-19(16-32-24)17-8-10-18(11-9-17)33(28,29)26-12-4-1-5-13-26;1-18-7-3-4-8-23(18)30-16-20(27)15-24-25-22(17-31-24)19-9-11-21(12-10-19)32(28,29)26-13-5-2-6-14-26;1-18-5-9-21(10-6-18)30-16-20(27)15-24-25-23(17-31-24)19-7-11-22(12-8-19)32(28,29)26-13-3-2-4-14-26;1-18-6-5-7-21(14-18)30-16-20(27)15-24-25-23(17-31-24)19-8-10-22(11-9-19)32(28,29)26-12-3-2-4-13-26;1-22(2)27(24,25)17-9-5-15(6-10-17)18-13-26-19(21-18)12-20-11-14-3-7-16(23)8-4-14;1-16-15-17-14(11-21-15)12-5-7-13(8-6-12)22(19,20)18-9-3-2-4-10-18;15-14-16-13(10-20-14)11-4-6-12(7-5-11)21(18,19)17-8-2-1-3-9-17/h6-13,18H,2-5,14-17H2,1H3;2-3,6-11,16,23H,1,4-5,12-15H2;3-4,7-12,17H,2,5-6,13-16H2,1H3;5-12,17H,2-4,13-16H2,1H3;5-11,14,17H,2-4,12-13,15-16H2,1H3;3-11,13,23H,12H2,1-2H3;5-8,11H,2-4,9-10H2,1H3,(H,16,17);4-7,10H,1-3,8-9H2,(H2,15,16)/b;;;;;20-11+;;
InChIKeyWDUVKKRPYVHMRP-WVMCQOBTSA-N
XLogP31.10
TPSA613.53 Ų
H-Bond Donors3
H-Bond Acceptors47
Rotatable Bonds52
Heavy Atoms232
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003443.52
LogP ≤ 531.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1047

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine (CID 161476741) is 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine is CCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.CN(C)S(=O)(=O)c1ccc(-c2csc(C/N=C/c3ccc(O)cc3)n2)cc1.CNc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Cc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1cccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)c1.Cc1ccccc1OCC(=O)Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.Nc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1.
What is the InChIKey of 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine?
The InChIKey is WDUVKKRPYVHMRP-WVMCQOBTSA-N. The full InChI is InChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C19H19N3O3S2.C15H19N3O2S2.C14H17N3O2S2/c1-2-19-6-10-22(11-7-19)31-17-21(28)16-25-26-24(18-32-25)20-8-12-23(13-9-20)33(29,30)27-14-4-3-5-15-27;27-20(23-15-30-21-6-2-3-7-22(21)31-23)14-24-25-19(16-32-24)17-8-10-18(11-9-17)33(28,29)26-12-4-1-5-13-26;1-18-7-3-4-8-23(18)30-16-20(27)15-24-25-22(17-31-24)19-9-11-21(12-10-19)32(28,29)26-13-5-2-6-14-26;1-18-5-9-21(10-6-18)30-16-20(27)15-24-25-23(17-31-24)19-7-11-22(12-8-19)32(28,29)26-13-3-2-4-14-26;1-18-6-5-7-21(14-18)30-16-20(27)15-24-25-23(17-31-24)19-8-10-22(11-9-19)32(28,29)26-12-3-2-4-13-26;1-22(2)27(24,25)17-9-5-15(6-10-17)18-13-26-19(21-18)12-20-11-14-3-7-16(23)8-4-14;1-16-15-17-14(11-21-15)12-5-7-13(8-6-12)22(19,20)18-9-3-2-4-10-18;15-14-16-13(10-20-14)11-4-6-12(7-5-11)21(18,19)17-8-2-1-3-9-17/h6-13,18H,2-5,14-17H2,1H3;2-3,6-11,16,23H,1,4-5,12-15H2;3-4,7-12,17H,2,5-6,13-16H2,1H3;5-12,17H,2-4,13-16H2,1H3;5-11,14,17H,2-4,12-13,15-16H2,1H3;3-11,13,23H,12H2,1-2H3;5-8,11H,2-4,9-10H2,1H3,(H,16,17);4-7,10H,1-3,8-9H2,(H2,15,16)/b;;;;;20-11+;;.
What are the key properties of 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine?
1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine has a molecular weight of 3443.52 g/mol, XLogP of 31.10, 52 rotatable bonds, 3 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanone;1-(4-ethylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-[2-[[(4-hydroxyphenyl)methylideneamino]methyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide;1-(2-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(3-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;1-(4-methylphenoxy)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;N-methyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine;4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 161476741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).