2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole

C203H227N19O31S18 — CID 159448951

IUPAC2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole
SMILESCCN(CC)S(=O)(=O)c1ccc(-c2csc(CC(=O)CC(C)C)n2)cc1.CCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1ccc(CC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.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.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1.O=S(=O)(c1ccc(-c2csc(Cc3ccccc3)n2)cc1)N1CCCCC1.O=S(=O)(c1ccc(-c2csc(N3CCCC3)n2)cc1)N1CCCCC1
InChIInChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C24H26N2O3S2.C21H22N2O2S2.C19H26N2O3S2.C18H23N3O2S2/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;1-18-5-7-19(8-6-18)15-21(27)16-24-25-23(17-30-24)20-9-11-22(12-10-20)31(28,29)26-13-3-2-4-14-26;24-27(25,23-13-5-2-6-14-23)19-11-9-18(10-12-19)20-16-26-21(22-20)15-17-7-3-1-4-8-17;1-5-21(6-2)26(23,24)17-9-7-15(8-10-17)18-13-25-19(20-18)12-16(22)11-14(3)4;22-25(23,21-12-2-1-3-13-21)16-8-6-15(7-9-16)17-14-24-18(19-17)20-10-4-5-11-20/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;5-12,17H,2-4,13-16H2,1H3;1,3-4,7-12,16H,2,5-6,13-15H2;7-10,13-14H,5-6,11-12H2,1-4H3;6-9,14H,1-5,10-13H2
InChIKeyLTCQXORZNVJJNP-UHFFFAOYSA-N
MW4006.36 g/mol
LogP38.93
Rot. Bonds64

About 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole

2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole (PubChem CID 159448951) has the molecular formula C203H227N19O31S18 and a molecular weight of 4006.36 g/mol. Its IUPAC name is 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole.

Molecular Properties

Compound Name2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole
PubChem CID159448951
Molecular FormulaC203H227N19O31S18
Molecular Weight4006.36 g/mol
Exact Mass4002.17
IUPAC Name2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole
SMILESCCN(CC)S(=O)(=O)c1ccc(-c2csc(CC(=O)CC(C)C)n2)cc1.CCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1ccc(CC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.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.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1.O=S(=O)(c1ccc(-c2csc(Cc3ccccc3)n2)cc1)N1CCCCC1.O=S(=O)(c1ccc(-c2csc(N3CCCC3)n2)cc1)N1CCCCC1
InChIInChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C24H26N2O3S2.C21H22N2O2S2.C19H26N2O3S2.C18H23N3O2S2/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;1-18-5-7-19(8-6-18)15-21(27)16-24-25-23(17-30-24)20-9-11-22(12-10-20)31(28,29)26-13-3-2-4-14-26;24-27(25,23-13-5-2-6-14-23)19-11-9-18(10-12-19)20-16-26-21(22-20)15-17-7-3-1-4-8-17;1-5-21(6-2)26(23,24)17-9-7-15(8-10-17)18-13-25-19(20-18)12-16(22)11-14(3)4;22-25(23,21-12-2-1-3-13-21)16-8-6-15(7-9-16)17-14-24-18(19-17)20-10-4-5-11-20/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;5-12,17H,2-4,13-16H2,1H3;1,3-4,7-12,16H,2,5-6,13-15H2;7-10,13-14H,5-6,11-12H2,1-4H3;6-9,14H,1-5,10-13H2
InChIKeyLTCQXORZNVJJNP-UHFFFAOYSA-N
XLogP38.93
TPSA630.54 Ų
H-Bond Donors
H-Bond Acceptors50
Rotatable Bonds64
Heavy Atoms271
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004006.36
LogP ≤ 538.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1050

Analyze 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The IUPAC name of 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole (CID 159448951) is 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole.
What is the SMILES notation for 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The canonical SMILES for 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole is CCN(CC)S(=O)(=O)c1ccc(-c2csc(CC(=O)CC(C)C)n2)cc1.CCc1ccc(OCC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.Cc1ccc(CC(=O)Cc2nc(-c3ccc(S(=O)(=O)N4CCCCC4)cc3)cs2)cc1.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.O=C(Cc1nc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cs1)C1COc2ccccc2O1.O=S(=O)(c1ccc(-c2csc(Cc3ccccc3)n2)cc1)N1CCCCC1.O=S(=O)(c1ccc(-c2csc(N3CCCC3)n2)cc1)N1CCCCC1.
What is the InChIKey of 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
The InChIKey is LTCQXORZNVJJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O4S2.C24H24N2O5S2.3C24H26N2O4S2.C24H26N2O3S2.C21H22N2O2S2.C19H26N2O3S2.C18H23N3O2S2/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;1-18-5-7-19(8-6-18)15-21(27)16-24-25-23(17-30-24)20-9-11-22(12-10-20)31(28,29)26-13-3-2-4-14-26;24-27(25,23-13-5-2-6-14-23)19-11-9-18(10-12-19)20-16-26-21(22-20)15-17-7-3-1-4-8-17;1-5-21(6-2)26(23,24)17-9-7-15(8-10-17)18-13-25-19(20-18)12-16(22)11-14(3)4;22-25(23,21-12-2-1-3-13-21)16-8-6-15(7-9-16)17-14-24-18(19-17)20-10-4-5-11-20/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;5-12,17H,2-4,13-16H2,1H3;1,3-4,7-12,16H,2,5-6,13-15H2;7-10,13-14H,5-6,11-12H2,1-4H3;6-9,14H,1-5,10-13H2.
What are the key properties of 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole?
2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole has a molecular weight of 4006.36 g/mol, XLogP of 38.93, 64 rotatable bonds, 0 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazole;N,N-diethyl-4-[2-(4-methyl-2-oxopentyl)-1,3-thiazol-4-yl]benzenesulfonamide;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;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;1-(4-methylphenyl)-3-[4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]propan-2-one;4-(4-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-yl-1,3-thiazole is sourced from PubChem (CID 159448951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).