N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide

C199H183ClF4N26O27S7 — CID 158412311

IUPACN-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.Cc1ccc(O)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(Nc1ccccc1Cl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2cc(F)ccc2O)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(F)cc2F)CC1.[C-]#[N+]c1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1
InChIInChI=1S/C29H25N5O4S.C29H28N4O4S.C29H29N3O4S.C28H25ClN4O4S.C28H25F2N3O3S.C28H25FN4O4S.C28H26FN3O4S/c1-30-24-11-13-25(14-12-24)32-29(36)34-18-16-33(17-19-34)28(35)23-9-7-21(8-10-23)20-39(37,38)26-6-2-4-22-5-3-15-31-27(22)26;1-21-7-13-25(14-8-21)31-29(35)33-18-16-32(17-19-33)28(34)24-11-9-22(10-12-24)20-38(36,37)26-6-2-4-23-5-3-15-30-27(23)26;1-21-7-12-26(33)25(18-21)19-31-14-16-32(17-15-31)29(34)24-10-8-22(9-11-24)20-37(35,36)27-6-2-4-23-5-3-13-30-28(23)27;29-23-7-1-2-8-24(23)31-28(35)33-17-15-32(16-18-33)27(34)22-12-10-20(11-13-22)19-38(36,37)25-9-3-5-21-6-4-14-30-26(21)25;29-24-11-10-23(25(30)17-24)18-32-13-15-33(16-14-32)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-31-27(21)26;29-23-10-12-24(13-11-23)31-28(35)33-17-15-32(16-18-33)27(34)22-8-6-20(7-9-22)19-38(36,37)25-5-1-3-21-4-2-14-30-26(21)25;29-24-10-11-25(33)23(17-24)18-31-13-15-32(16-14-31)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-30-27(21)26/h2-15H,16-20H2,(H,32,36);2-15H,16-20H2,1H3,(H,31,35);2-13,18,33H,14-17,19-20H2,1H3;1-14H,15-19H2,(H,31,35);1-12,17H,13-16,18-19H2;1-14H,15-19H2,(H,31,35);1-12,17,33H,13-16,18-19H2
InChIKeyGZLSDOZPQFYGIU-UHFFFAOYSA-N
MW3706.72 g/mol
LogP31.08
Rot. Bonds38

About N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide

N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide (PubChem CID 158412311) has the molecular formula C199H183ClF4N26O27S7 and a molecular weight of 3706.72 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide
PubChem CID158412311
Molecular FormulaC199H183ClF4N26O27S7
Molecular Weight3706.72 g/mol
Exact Mass3703.14
IUPAC NameN-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.Cc1ccc(O)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(Nc1ccccc1Cl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2cc(F)ccc2O)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(F)cc2F)CC1.[C-]#[N+]c1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1
InChIInChI=1S/C29H25N5O4S.C29H28N4O4S.C29H29N3O4S.C28H25ClN4O4S.C28H25F2N3O3S.C28H25FN4O4S.C28H26FN3O4S/c1-30-24-11-13-25(14-12-24)32-29(36)34-18-16-33(17-19-34)28(35)23-9-7-21(8-10-23)20-39(37,38)26-6-2-4-22-5-3-15-31-27(22)26;1-21-7-13-25(14-8-21)31-29(35)33-18-16-32(17-19-33)28(34)24-11-9-22(10-12-24)20-38(36,37)26-6-2-4-23-5-3-15-30-27(23)26;1-21-7-12-26(33)25(18-21)19-31-14-16-32(17-15-31)29(34)24-10-8-22(9-11-24)20-37(35,36)27-6-2-4-23-5-3-13-30-28(23)27;29-23-7-1-2-8-24(23)31-28(35)33-17-15-32(16-18-33)27(34)22-12-10-20(11-13-22)19-38(36,37)25-9-3-5-21-6-4-14-30-26(21)25;29-24-11-10-23(25(30)17-24)18-32-13-15-33(16-14-32)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-31-27(21)26;29-23-10-12-24(13-11-23)31-28(35)33-17-15-32(16-18-33)27(34)22-8-6-20(7-9-22)19-38(36,37)25-5-1-3-21-4-2-14-30-26(21)25;29-24-10-11-25(33)23(17-24)18-31-13-15-32(16-14-31)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-30-27(21)26/h2-15H,16-20H2,(H,32,36);2-15H,16-20H2,1H3,(H,31,35);2-13,18,33H,14-17,19-20H2,1H3;1-14H,15-19H2,(H,31,35);1-12,17H,13-16,18-19H2;1-14H,15-19H2,(H,31,35);1-12,17,33H,13-16,18-19H2
InChIKeyGZLSDOZPQFYGIU-UHFFFAOYSA-N
XLogP31.08
TPSA655.28 Ų
H-Bond Donors6
H-Bond Acceptors37
Rotatable Bonds38
Heavy Atoms264
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003706.72
LogP ≤ 531.08
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide with MolForge

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Related Compounds

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-[(4-Chlorophenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-2-hydroxyphenyl)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;[4-[(3-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
CID 161828396

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide (CID 158412311) is N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide is Cc1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.Cc1ccc(O)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(Nc1ccccc1Cl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2cc(F)ccc2O)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(F)cc2F)CC1.[C-]#[N+]c1ccc(NC(=O)N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.
What is the InChIKey of N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide?
The InChIKey is GZLSDOZPQFYGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H25N5O4S.C29H28N4O4S.C29H29N3O4S.C28H25ClN4O4S.C28H25F2N3O3S.C28H25FN4O4S.C28H26FN3O4S/c1-30-24-11-13-25(14-12-24)32-29(36)34-18-16-33(17-19-34)28(35)23-9-7-21(8-10-23)20-39(37,38)26-6-2-4-22-5-3-15-31-27(22)26;1-21-7-13-25(14-8-21)31-29(35)33-18-16-32(17-19-33)28(34)24-11-9-22(10-12-24)20-38(36,37)26-6-2-4-23-5-3-15-30-27(23)26;1-21-7-12-26(33)25(18-21)19-31-14-16-32(17-15-31)29(34)24-10-8-22(9-11-24)20-37(35,36)27-6-2-4-23-5-3-13-30-28(23)27;29-23-7-1-2-8-24(23)31-28(35)33-17-15-32(16-18-33)27(34)22-12-10-20(11-13-22)19-38(36,37)25-9-3-5-21-6-4-14-30-26(21)25;29-24-11-10-23(25(30)17-24)18-32-13-15-33(16-14-32)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-31-27(21)26;29-23-10-12-24(13-11-23)31-28(35)33-17-15-32(16-18-33)27(34)22-8-6-20(7-9-22)19-38(36,37)25-5-1-3-21-4-2-14-30-26(21)25;29-24-10-11-25(33)23(17-24)18-31-13-15-32(16-14-31)28(34)22-8-6-20(7-9-22)19-37(35,36)26-5-1-3-21-4-2-12-30-27(21)26/h2-15H,16-20H2,(H,32,36);2-15H,16-20H2,1H3,(H,31,35);2-13,18,33H,14-17,19-20H2,1H3;1-14H,15-19H2,(H,31,35);1-12,17H,13-16,18-19H2;1-14H,15-19H2,(H,31,35);1-12,17,33H,13-16,18-19H2.
What are the key properties of N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide?
N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide has a molecular weight of 3706.72 g/mol, XLogP of 31.08, 38 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-fluorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[(2-hydroxy-5-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-isocyanophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide is sourced from PubChem (CID 158412311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).