(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide

C191H169F9N28O26S7 — CID 162242356

IUPAC(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
SMILESCOc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(F)c(F)c1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2c(F)cccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2cnccn2)CC1.O=C(c1ccncc1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1
InChIInChI=1S/C29H29N3O4S.C29H29N3O3S.C28H26FN3O3S.2C27H21F3N4O4S.C26H22FN5O4S.C25H21FN6O4S/c1-36-26-19-24(29(33)32-17-15-31(16-18-32)20-22-7-3-2-4-8-22)12-13-25(26)21-37(34,35)27-11-5-9-23-10-6-14-30-28(23)27;1-22-19-25(29(33)32-17-15-31(16-18-32)20-23-7-3-2-4-8-23)12-13-26(22)21-36(34,35)27-11-5-9-24-10-6-14-30-28(24)27;29-25-18-23(28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21)11-12-24(25)20-36(34,35)26-10-4-8-22-9-5-13-30-27(22)26;28-19-6-2-7-20(29)24(19)27(36)34-14-12-33(13-15-34)26(35)18-9-10-22(21(30)16-18)32-39(37,38)23-8-1-4-17-5-3-11-31-25(17)23;28-20-8-6-18(15-21(20)29)26(35)33-11-13-34(14-12-33)27(36)19-7-9-23(22(30)16-19)32-39(37,38)24-5-1-3-17-4-2-10-31-25(17)24;27-21-17-20(26(34)32-15-13-31(14-16-32)25(33)19-8-11-28-12-9-19)6-7-22(21)30-37(35,36)23-5-1-3-18-4-2-10-29-24(18)23;26-19-15-18(24(33)31-11-13-32(14-12-31)25(34)21-16-27-9-10-28-21)6-7-20(19)30-37(35,36)22-5-1-3-17-4-2-8-29-23(17)22/h2-14,19H,15-18,20-21H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-13,18H,14-17,19-20H2;1-11,16,32H,12-15H2;1-10,15-16,32H,11-14H2;1-12,17,30H,13-16H2;1-10,15-16,30H,11-14H2
InChIKeyZWWGFAHGERQQKG-UHFFFAOYSA-N
MW3668.07 g/mol
LogP26.79
Rot. Bonds39

About (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide

(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide (PubChem CID 162242356) has the molecular formula C191H169F9N28O26S7 and a molecular weight of 3668.07 g/mol. Its IUPAC name is (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide.

Molecular Properties

Compound Name(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
PubChem CID162242356
Molecular FormulaC191H169F9N28O26S7
Molecular Weight3668.07 g/mol
Exact Mass3665.07
IUPAC Name(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
SMILESCOc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(F)c(F)c1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2c(F)cccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2cnccn2)CC1.O=C(c1ccncc1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1
InChIInChI=1S/C29H29N3O4S.C29H29N3O3S.C28H26FN3O3S.2C27H21F3N4O4S.C26H22FN5O4S.C25H21FN6O4S/c1-36-26-19-24(29(33)32-17-15-31(16-18-32)20-22-7-3-2-4-8-22)12-13-25(26)21-37(34,35)27-11-5-9-23-10-6-14-30-28(23)27;1-22-19-25(29(33)32-17-15-31(16-18-32)20-23-7-3-2-4-8-23)12-13-26(22)21-36(34,35)27-11-5-9-24-10-6-14-30-28(24)27;29-25-18-23(28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21)11-12-24(25)20-36(34,35)26-10-4-8-22-9-5-13-30-27(22)26;28-19-6-2-7-20(29)24(19)27(36)34-14-12-33(13-15-34)26(35)18-9-10-22(21(30)16-18)32-39(37,38)23-8-1-4-17-5-3-11-31-25(17)23;28-20-8-6-18(15-21(20)29)26(35)33-11-13-34(14-12-33)27(36)19-7-9-23(22(30)16-19)32-39(37,38)24-5-1-3-17-4-2-10-31-25(17)24;27-21-17-20(26(34)32-15-13-31(14-16-32)25(33)19-8-11-28-12-9-19)6-7-22(21)30-37(35,36)23-5-1-3-18-4-2-10-29-24(18)23;26-19-15-18(24(33)31-11-13-32(14-12-31)25(34)21-16-27-9-10-28-21)6-7-20(19)30-37(35,36)22-5-1-3-17-4-2-8-29-23(17)22/h2-14,19H,15-18,20-21H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-13,18H,14-17,19-20H2;1-11,16,32H,12-15H2;1-10,15-16,32H,11-14H2;1-12,17,30H,13-16H2;1-10,15-16,30H,11-14H2
InChIKeyZWWGFAHGERQQKG-UHFFFAOYSA-N
XLogP26.79
TPSA658.36 Ų
H-Bond Donors4
H-Bond Acceptors39
Rotatable Bonds39
Heavy Atoms261
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003668.07
LogP ≤ 526.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1039

Analyze (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide with MolForge

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Related Compounds

N-[4-[4-(3-methoxy-2-methylbenzoyl)piperazine-1-carbonyl]-2-(trifluoromethyl)phenyl]quinoline-8-sulfonamide
CID 129043281
[4-[(3-Fluoro-4-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(3-methoxy-2-pyridinyl)piperazin-1-yl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(3-methoxy-4-pyridinyl)piperazin-1-yl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 157339022
[4-[(2,3-dichlorophenyl)methyl]piperazin-1-yl]-[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]-2-(trifluoromethyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(pyridine-3-carbonyl)piperazine-1-carbonyl]-2-(trifluoromethyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]-2-(trifluoromethyl)phenyl]quinoline-8-sulfonamide
CID 158029148
N-[4-[4-(5-chloropyridine-3-carbonyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(4-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[[3-(2-methylpropoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-methyl-4-[4-[4-(trifluoromethyl)pyridine-3-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone
CID 158497825
N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[(2,5-dihydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[(3-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-methyl-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperazin-1-yl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)-3-pyridinyl]methyl]piperazin-1-yl]methanone
CID 158593342
[4-(Cyclohexylmethyl)piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dihydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-3-ylmethyl)piperazin-1-yl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperazin-1-yl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)-3-pyridinyl]methyl]piperazin-1-yl]methanone
CID 158965906
N-[4-[4-(5-chloropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-(5-chloropyridine-3-carbonyl)piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide;[4-[(5-chloro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(5-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide;N-[2-methoxy-4-[4-[4-(trifluoromethyl)pyridine-3-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)-3-pyridinyl]methyl]piperazin-1-yl]methanone
CID 159633227
N-[4-[4-(3-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylethyl)piperazin-1-yl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(3-phenylpropyl)piperazin-1-yl]methanone;N-[2-methoxy-4-[4-(5-methylpyridine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-methoxy-4-[4-[3-(trifluoromethyl)pyridine-2-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 159783979
N-[4-[4-(2-methoxypyridine-4-carbonyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;N-[2-methyl-4-[4-(5-methylpyridine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-methyl-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-methyl-4-[4-[2-(trifluoromethyl)pyridine-3-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[4-[(1-phenylcyclopropyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(1-phenylethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(3-phenylpropyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]phenyl] acetate
CID 161432415
[4-[(3-Chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-dichlorophenyl)methyl]piperazin-1-yl]-[2-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 161603010
N-[4-[4-(4-chloropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;N-[4-[4-(3-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[(3-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-methyl-4-[4-(6-methylpyridine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-methyl-4-[4-[3-(trifluoromethyl)pyridine-2-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]phenyl] acetate;[4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]phenyl] butanoate
CID 162132940
3-[8-[[4-[4-[(2,3-difluorophenyl)methyl]piperazine-1-carbonyl]-2-methylphenyl]sulfamoyl]quinolin-6-yl]-N-[3-methoxy-4-[4-[5-(trifluoromethyl)pyridine-2-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 170079628

Frequently Asked Questions

What is the IUPAC name of (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The IUPAC name of (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide (CID 162242356) is (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide.
What is the SMILES notation for (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The canonical SMILES for (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide is COc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(F)c(F)c1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2c(F)cccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(C(=O)c2cnccn2)CC1.O=C(c1ccncc1)N1CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)c(F)c2)CC1.
What is the InChIKey of (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The InChIKey is ZWWGFAHGERQQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29N3O4S.C29H29N3O3S.C28H26FN3O3S.2C27H21F3N4O4S.C26H22FN5O4S.C25H21FN6O4S/c1-36-26-19-24(29(33)32-17-15-31(16-18-32)20-22-7-3-2-4-8-22)12-13-25(26)21-37(34,35)27-11-5-9-23-10-6-14-30-28(23)27;1-22-19-25(29(33)32-17-15-31(16-18-32)20-23-7-3-2-4-8-23)12-13-26(22)21-36(34,35)27-11-5-9-24-10-6-14-30-28(24)27;29-25-18-23(28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21)11-12-24(25)20-36(34,35)26-10-4-8-22-9-5-13-30-27(22)26;28-19-6-2-7-20(29)24(19)27(36)34-14-12-33(13-15-34)26(35)18-9-10-22(21(30)16-18)32-39(37,38)23-8-1-4-17-5-3-11-31-25(17)23;28-20-8-6-18(15-21(20)29)26(35)33-11-13-34(14-12-33)27(36)19-7-9-23(22(30)16-19)32-39(37,38)24-5-1-3-17-4-2-10-31-25(17)24;27-21-17-20(26(34)32-15-13-31(14-16-32)25(33)19-8-11-28-12-9-19)6-7-22(21)30-37(35,36)23-5-1-3-18-4-2-10-29-24(18)23;26-19-15-18(24(33)31-11-13-32(14-12-31)25(34)21-16-27-9-10-28-21)6-7-20(19)30-37(35,36)22-5-1-3-17-4-2-8-29-23(17)22/h2-14,19H,15-18,20-21H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-13,18H,14-17,19-20H2;1-11,16,32H,12-15H2;1-10,15-16,32H,11-14H2;1-12,17,30H,13-16H2;1-10,15-16,30H,11-14H2.
What are the key properties of (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
(4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide has a molecular weight of 3668.07 g/mol, XLogP of 26.79, 39 rotatable bonds, 4 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylpiperazin-1-yl)-[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide is sourced from PubChem (CID 162242356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).