N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide

C189H175Cl2F8N23O29S7 — CID 160731820

IUPACN-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide
SMILESCCCCC1(O)CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCC(O)(c2ccccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccc(F)c2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccnc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2cc(F)ccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ccccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ncccc2C(F)(F)F)CC1
InChIInChI=1S/C28H26ClN3O5S.C28H25F2N3O4S.C27H23ClFN3O4S.C27H23F3N4O4S.C27H25FN4O4S.C27H24FN3O4S.C25H29N3O4S/c1-37-24-18-20(31-38(35,36)25-10-4-6-19-7-5-15-30-26(19)25)11-12-21(24)27(33)32-16-13-28(34,14-17-32)22-8-2-3-9-23(22)29;29-23-7-1-5-21(25(23)30)18-28(35)13-16-33(17-14-28)27(34)20-9-11-22(12-10-20)32-38(36,37)24-8-2-4-19-6-3-15-31-26(19)24;28-23-11-8-20(29)17-22(23)27(34)12-15-32(16-13-27)26(33)19-6-9-21(10-7-19)31-37(35,36)24-5-1-3-18-4-2-14-30-25(18)24;28-27(29,30)21-6-3-15-32-24(21)26(36)12-16-34(17-13-26)25(35)19-8-10-20(11-9-19)33-39(37,38)22-7-1-4-18-5-2-14-31-23(18)22;28-25-21(6-3-15-30-25)18-27(34)12-16-32(17-13-27)26(33)20-8-10-22(11-9-20)31-37(35,36)23-7-1-4-19-5-2-14-29-24(19)23;28-23-8-2-1-7-22(23)27(33)14-17-31(18-15-27)26(32)20-10-12-21(13-11-20)30-36(34,35)24-9-3-5-19-6-4-16-29-25(19)24;1-2-3-13-25(30)14-17-28(18-15-25)24(29)20-9-11-21(12-10-20)27-33(31,32)22-8-4-6-19-7-5-16-26-23(19)22/h2-12,15,18,31,34H,13-14,16-17H2,1H3;1-12,15,32,35H,13-14,16-18H2;1-11,14,17,31,34H,12-13,15-16H2;1-11,14-15,33,36H,12-13,16-17H2;1-11,14-15,31,34H,12-13,16-18H2;1-13,16,30,33H,14-15,17-18H2;4-12,16,27,30H,2-3,13-15,17-18H2,1H3
InChIKeyRULFNSNKMUGCBK-UHFFFAOYSA-N
MW3679.97 g/mol
LogP31.14
Rot. Bonds40

About N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide

N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide (PubChem CID 160731820) has the molecular formula C189H175Cl2F8N23O29S7 and a molecular weight of 3679.97 g/mol. Its IUPAC name is N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide
PubChem CID160731820
Molecular FormulaC189H175Cl2F8N23O29S7
Molecular Weight3679.97 g/mol
Exact Mass3676.02
IUPAC NameN-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide
SMILESCCCCC1(O)CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCC(O)(c2ccccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccc(F)c2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccnc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2cc(F)ccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ccccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ncccc2C(F)(F)F)CC1
InChIInChI=1S/C28H26ClN3O5S.C28H25F2N3O4S.C27H23ClFN3O4S.C27H23F3N4O4S.C27H25FN4O4S.C27H24FN3O4S.C25H29N3O4S/c1-37-24-18-20(31-38(35,36)25-10-4-6-19-7-5-15-30-26(19)25)11-12-21(24)27(33)32-16-13-28(34,14-17-32)22-8-2-3-9-23(22)29;29-23-7-1-5-21(25(23)30)18-28(35)13-16-33(17-14-28)27(34)20-9-11-22(12-10-20)32-38(36,37)24-8-2-4-19-6-3-15-31-26(19)24;28-23-11-8-20(29)17-22(23)27(34)12-15-32(16-13-27)26(33)19-6-9-21(10-7-19)31-37(35,36)24-5-1-3-18-4-2-14-30-25(18)24;28-27(29,30)21-6-3-15-32-24(21)26(36)12-16-34(17-13-26)25(35)19-8-10-20(11-9-19)33-39(37,38)22-7-1-4-18-5-2-14-31-23(18)22;28-25-21(6-3-15-30-25)18-27(34)12-16-32(17-13-27)26(33)20-8-10-22(11-9-20)31-37(35,36)23-7-1-4-19-5-2-14-29-24(19)23;28-23-8-2-1-7-22(23)27(33)14-17-31(18-15-27)26(32)20-10-12-21(13-11-20)30-36(34,35)24-9-3-5-19-6-4-16-29-25(19)24;1-2-3-13-25(30)14-17-28(18-15-25)24(29)20-9-11-21(12-10-20)27-33(31,32)22-8-4-6-19-7-5-16-26-23(19)22/h2-12,15,18,31,34H,13-14,16-17H2,1H3;1-12,15,32,35H,13-14,16-18H2;1-11,14,17,31,34H,12-13,15-16H2;1-11,14-15,33,36H,12-13,16-17H2;1-11,14-15,31,34H,12-13,16-18H2;1-13,16,30,33H,14-15,17-18H2;4-12,16,27,30H,2-3,13-15,17-18H2,1H3
InChIKeyRULFNSNKMUGCBK-UHFFFAOYSA-N
XLogP31.14
TPSA732.21 Ų
H-Bond Donors14
H-Bond Acceptors38
Rotatable Bonds40
Heavy Atoms258
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003679.97
LogP ≤ 531.14
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide with MolForge

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Launch Full Analysis

Related Compounds

N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 90418904
N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-(difluoromethoxy)phenyl]quinoline-8-sulfonamide
CID 90418994
N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-(trifluoromethoxy)phenyl]quinoline-8-sulfonamide
CID 90419010
N-[4-[4-[(4-chloro-2-fluorophenyl)methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 67504818
N-[4-[4-[(4-chloro-3-fluorophenyl)methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 67504948
N-[4-[4-[(3-chloro-4-fluorophenyl)methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 67505479
N-[4-[4-(3-chlorohexa-2,4-dien-2-yl)-4-hydroxypiperidine-1-carbonyl]-3-(difluoromethoxy)phenyl]quinoline-8-sulfonamide
CID 123812004
N-[3-[2-[5-[4-[(4-chloro-3-fluorophenyl)methyl]piperazine-1-carbonyl]-2-(quinolin-8-ylsulfonylamino)phenyl]ethoxy]-4-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 129043381
N-[4-[4-[[3-chloro-4-(trifluoromethyl)phenyl]methyl]piperazine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide
CID 146253703
N-[3-(difluoromethoxy)-4-[4-hydroxy-4-(2-methylphenyl)piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 146582351
N-[4-[4-[(3Z,5Z)-2-chlorohepta-1,3,5-trien-3-yl]-4-hydroxypiperidine-1-carbonyl]-3-(trifluoromethoxy)phenyl]quinoline-8-sulfonamide
CID 146582429
N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-2-fluorophenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methylphenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-(trifluoromethoxy)phenyl]quinoline-8-sulfonamide;N-[4-[4-(4-fluoro-2-methylphenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(3-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[(3-methoxyphenyl)methyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-(2-methylpropyl)piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 157951496

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The IUPAC name of N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide (CID 160731820) is N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide.
What is the SMILES notation for N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The canonical SMILES for N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide is CCCCC1(O)CCN(C(=O)c2ccc(NS(=O)(=O)c3cccc4cccnc34)cc2)CC1.COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1C(=O)N1CCC(O)(c2ccccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccc(F)c2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(Cc2cccnc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2cc(F)ccc2Cl)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ccccc2F)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCC(O)(c2ncccc2C(F)(F)F)CC1.
What is the InChIKey of N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
The InChIKey is RULFNSNKMUGCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26ClN3O5S.C28H25F2N3O4S.C27H23ClFN3O4S.C27H23F3N4O4S.C27H25FN4O4S.C27H24FN3O4S.C25H29N3O4S/c1-37-24-18-20(31-38(35,36)25-10-4-6-19-7-5-15-30-26(19)25)11-12-21(24)27(33)32-16-13-28(34,14-17-32)22-8-2-3-9-23(22)29;29-23-7-1-5-21(25(23)30)18-28(35)13-16-33(17-14-28)27(34)20-9-11-22(12-10-20)32-38(36,37)24-8-2-4-19-6-3-15-31-26(19)24;28-23-11-8-20(29)17-22(23)27(34)12-15-32(16-13-27)26(33)19-6-9-21(10-7-19)31-37(35,36)24-5-1-3-18-4-2-14-30-25(18)24;28-27(29,30)21-6-3-15-32-24(21)26(36)12-16-34(17-13-26)25(35)19-8-10-20(11-9-19)33-39(37,38)22-7-1-4-18-5-2-14-31-23(18)22;28-25-21(6-3-15-30-25)18-27(34)12-16-32(17-13-27)26(33)20-8-10-22(11-9-20)31-37(35,36)23-7-1-4-19-5-2-14-29-24(19)23;28-23-8-2-1-7-22(23)27(33)14-17-31(18-15-27)26(32)20-10-12-21(13-11-20)30-36(34,35)24-9-3-5-19-6-4-16-29-25(19)24;1-2-3-13-25(30)14-17-28(18-15-25)24(29)20-9-11-21(12-10-20)27-33(31,32)22-8-4-6-19-7-5-16-26-23(19)22/h2-12,15,18,31,34H,13-14,16-17H2,1H3;1-12,15,32,35H,13-14,16-18H2;1-11,14,17,31,34H,12-13,15-16H2;1-11,14-15,33,36H,12-13,16-17H2;1-11,14-15,31,34H,12-13,16-18H2;1-13,16,30,33H,14-15,17-18H2;4-12,16,27,30H,2-3,13-15,17-18H2,1H3.
What are the key properties of N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide?
N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide has a molecular weight of 3679.97 g/mol, XLogP of 31.14, 40 rotatable bonds, 14 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-butyl-4-hydroxypiperidine-1-carbonyl)phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chloro-5-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-chlorophenyl)-4-hydroxypiperidine-1-carbonyl]-3-methoxyphenyl]quinoline-8-sulfonamide;N-[4-[4-[(2,3-difluorophenyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-(2-fluorophenyl)-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-[(2-fluoro-3-pyridinyl)methyl]-4-hydroxypiperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[4-hydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]piperidine-1-carbonyl]phenyl]quinoline-8-sulfonamide is sourced from PubChem (CID 160731820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).