[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone

C206H207FN26O27S7 — CID 160738195

IUPAC[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
SMILESCOc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccc(C)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1.Cc1cc(C(=O)N2CCN(C(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(CC(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccn3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C31H32N4O5S.C31H33N3O3S.C30H30N4O5S.C30H31N3O3S.C29H28N4O5S.C28H28N4O3S.C27H25FN4O3S/c1-31(2,23-11-5-4-6-12-23)30(37)35-19-17-34(18-20-35)29(36)25-15-14-24(21-26(25)40-3)33-41(38,39)27-13-7-9-22-10-8-16-32-28(22)27;1-23-20-27(31(35)34-18-16-33(17-19-34)21-24(2)25-8-4-3-5-9-25)13-14-28(23)22-38(36,37)29-12-6-10-26-11-7-15-32-30(26)29;1-21-8-10-22(11-9-21)19-28(35)33-15-17-34(18-16-33)30(36)25-13-12-24(20-26(25)39-2)32-40(37,38)27-7-3-5-23-6-4-14-31-29(23)27;1-22-20-26(30(34)33-18-16-32(17-19-33)23(2)24-8-4-3-5-9-24)13-14-27(22)21-37(35,36)28-12-6-10-25-11-7-15-31-29(25)28;1-38-25-20-23(31-39(36,37)26-11-5-9-22-10-6-14-30-28(22)26)12-13-24(25)29(35)33-17-15-32(16-18-33)27(34)19-21-7-3-2-4-8-21;1-21-18-23(28(33)32-16-14-31(15-17-32)19-25-8-2-3-12-29-25)10-11-24(21)20-36(34,35)26-9-4-6-22-7-5-13-30-27(22)26;28-24-17-21(27(33)32-15-13-31(14-16-32)18-23-7-1-2-11-29-23)9-10-22(24)19-36(34,35)25-8-3-5-20-6-4-12-30-26(20)25/h4-16,21,33H,17-20H2,1-3H3;3-15,20,24H,16-19,21-22H2,1-2H3;3-14,20,32H,15-19H2,1-2H3;3-15,20,23H,16-19,21H2,1-2H3;2-14,20,31H,15-19H2,1H3;2-13,18H,14-17,19-20H2,1H3;1-12,17H,13-16,18-19H2
InChIKeyRVFOZMYHKNDSLR-UHFFFAOYSA-N
MW3722.54 g/mol
LogP29.44
Rot. Bonds46

About [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone

[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone (PubChem CID 160738195) has the molecular formula C206H207FN26O27S7 and a molecular weight of 3722.54 g/mol. Its IUPAC name is [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
PubChem CID160738195
Molecular FormulaC206H207FN26O27S7
Molecular Weight3722.54 g/mol
Exact Mass3719.37
IUPAC Name[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone
SMILESCOc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccc(C)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1.Cc1cc(C(=O)N2CCN(C(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(CC(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccn3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C31H32N4O5S.C31H33N3O3S.C30H30N4O5S.C30H31N3O3S.C29H28N4O5S.C28H28N4O3S.C27H25FN4O3S/c1-31(2,23-11-5-4-6-12-23)30(37)35-19-17-34(18-20-35)29(36)25-15-14-24(21-26(25)40-3)33-41(38,39)27-13-7-9-22-10-8-16-32-28(22)27;1-23-20-27(31(35)34-18-16-33(17-19-34)21-24(2)25-8-4-3-5-9-25)13-14-28(23)22-38(36,37)29-12-6-10-26-11-7-15-32-30(26)29;1-21-8-10-22(11-9-21)19-28(35)33-15-17-34(18-16-33)30(36)25-13-12-24(20-26(25)39-2)32-40(37,38)27-7-3-5-23-6-4-14-31-29(23)27;1-22-20-26(30(34)33-18-16-32(17-19-33)23(2)24-8-4-3-5-9-24)13-14-27(22)21-37(35,36)28-12-6-10-25-11-7-15-31-29(25)28;1-38-25-20-23(31-39(36,37)26-11-5-9-22-10-6-14-30-28(22)26)12-13-24(25)29(35)33-17-15-32(16-18-33)27(34)19-21-7-3-2-4-8-21;1-21-18-23(28(33)32-16-14-31(15-17-32)19-25-8-2-3-12-29-25)10-11-24(21)20-36(34,35)26-9-4-6-22-7-5-13-30-27(22)26;28-24-17-21(27(33)32-15-13-31(14-16-32)18-23-7-1-2-11-29-23)9-10-22(24)19-36(34,35)25-8-3-5-20-6-4-12-30-26(20)25/h4-16,21,33H,17-20H2,1-3H3;3-15,20,24H,16-19,21-22H2,1-2H3;3-14,20,32H,15-19H2,1-2H3;3-15,20,23H,16-19,21H2,1-2H3;2-14,20,31H,15-19H2,1H3;2-13,18H,14-17,19-20H2,1H3;1-12,17H,13-16,18-19H2
InChIKeyRVFOZMYHKNDSLR-UHFFFAOYSA-N
XLogP29.44
TPSA634.83 Ų
H-Bond Donors3
H-Bond Acceptors40
Rotatable Bonds46
Heavy Atoms267
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003722.54
LogP ≤ 529.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1040

Analyze [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone with MolForge

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Related Compounds

N-[4-[4-(5-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 49854596
N-[4-[4-(3-fluoropyridine-4-carbonyl)piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59634767
N-[3-methoxy-4-[4-[4-(trifluoromethyl)pyridine-3-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59634869
N-[3-methoxy-4-[4-[5-(trifluoromethyl)pyridine-2-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59634955
N-[4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59634967
N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59634984
N-[4-[4-[(2-fluoro-4-methoxyphenyl)methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59635003
N-[4-[4-(3-fluoropyridine-2-carbonyl)piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59635013
N-[4-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59635029
N-[3-methoxy-4-[4-(2,3,4-trifluorobenzoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635064
N-[3-methoxy-4-[4-[3-(trifluoromethyl)pyridine-2-carbonyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635162
N-[4-[4-[2-(4-fluorophenyl)-2-methylpropanoyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 59635224

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone?
The IUPAC name of [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone (CID 160738195) is [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone.
What is the SMILES notation for [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone?
The canonical SMILES for [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone is COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccc(C)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1.Cc1cc(C(=O)N2CCN(C(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(CC(C)c3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccn3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)c(F)c1)N1CCN(Cc2ccccn2)CC1.
What is the InChIKey of [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone?
The InChIKey is RVFOZMYHKNDSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N4O5S.C31H33N3O3S.C30H30N4O5S.C30H31N3O3S.C29H28N4O5S.C28H28N4O3S.C27H25FN4O3S/c1-31(2,23-11-5-4-6-12-23)30(37)35-19-17-34(18-20-35)29(36)25-15-14-24(21-26(25)40-3)33-41(38,39)27-13-7-9-22-10-8-16-32-28(22)27;1-23-20-27(31(35)34-18-16-33(17-19-34)21-24(2)25-8-4-3-5-9-25)13-14-28(23)22-38(36,37)29-12-6-10-26-11-7-15-32-30(26)29;1-21-8-10-22(11-9-21)19-28(35)33-15-17-34(18-16-33)30(36)25-13-12-24(20-26(25)39-2)32-40(37,38)27-7-3-5-23-6-4-14-31-29(23)27;1-22-20-26(30(34)33-18-16-32(17-19-33)23(2)24-8-4-3-5-9-24)13-14-27(22)21-37(35,36)28-12-6-10-25-11-7-15-31-29(25)28;1-38-25-20-23(31-39(36,37)26-11-5-9-22-10-6-14-30-28(22)26)12-13-24(25)29(35)33-17-15-32(16-18-33)27(34)19-21-7-3-2-4-8-21;1-21-18-23(28(33)32-16-14-31(15-17-32)19-25-8-2-3-12-29-25)10-11-24(21)20-36(34,35)26-9-4-6-22-7-5-13-30-27(22)26;28-24-17-21(27(33)32-15-13-31(14-16-32)18-23-7-1-2-11-29-23)9-10-22(24)19-36(34,35)25-8-3-5-20-6-4-12-30-26(20)25/h4-16,21,33H,17-20H2,1-3H3;3-15,20,24H,16-19,21-22H2,1-2H3;3-14,20,32H,15-19H2,1-2H3;3-15,20,23H,16-19,21H2,1-2H3;2-14,20,31H,15-19H2,1H3;2-13,18H,14-17,19-20H2,1H3;1-12,17H,13-16,18-19H2.
What are the key properties of [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone?
[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone has a molecular weight of 3722.54 g/mol, XLogP of 29.44, 46 rotatable bonds, 3 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone;N-[3-methoxy-4-[4-[2-(4-methylphenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[3-methoxy-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1-phenylethyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylpropyl)piperazin-1-yl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 160738195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).