N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

C199H209ClF2N24O33S7 — CID 158989138

IUPACN-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCCOC(=O)CCCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOC(=O)CCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)ccc1O.CCOc1ccccc1CN1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.Cc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(C)c1O.O=C(NCCCCl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2OC(F)F)CC1
InChIInChI=1S/C30H31N3O5S.2C30H31N3O4S.C29H27F2N3O4S.C28H32N4O6S.C27H30N4O6S.C25H27ClN4O4S/c1-2-38-27-19-23(10-13-26(27)34)20-32-15-17-33(18-16-32)30(35)25-11-8-22(9-12-25)21-39(36,37)28-7-3-5-24-6-4-14-31-29(24)28;1-21-17-24(18-22(2)29(21)34)19-32-13-15-33(16-14-32)30(35)26-10-8-23(9-11-26)20-38(36,37)27-7-3-5-25-6-4-12-31-28(25)27;1-2-37-27-10-4-3-7-26(27)21-32-17-19-33(20-18-32)30(34)25-14-12-23(13-15-25)22-38(35,36)28-11-5-8-24-9-6-16-31-29(24)28;30-29(31)38-25-8-2-1-5-24(25)19-33-15-17-34(18-16-33)28(35)23-12-10-21(11-13-23)20-39(36,37)26-9-3-6-22-7-4-14-32-27(22)26;1-2-38-25(33)9-5-15-30-28(35)32-18-16-31(17-19-32)27(34)23-12-10-21(11-13-23)20-39(36,37)24-8-3-6-22-7-4-14-29-26(22)24;1-2-37-24(32)12-14-29-27(34)31-17-15-30(16-18-31)26(33)22-10-8-20(9-11-22)19-38(35,36)23-7-3-5-21-6-4-13-28-25(21)23;26-11-3-13-28-25(32)30-16-14-29(15-17-30)24(31)21-9-7-19(8-10-21)18-35(33,34)22-6-1-4-20-5-2-12-27-23(20)22/h3-14,19,34H,2,15-18,20-21H2,1H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;3-16H,2,17-22H2,1H3;1-14,29H,15-20H2;3-4,6-8,10-14H,2,5,9,15-20H2,1H3,(H,30,35);3-11,13H,2,12,14-19H2,1H3,(H,29,34);1-2,4-10,12H,3,11,13-18H2,(H,28,32)
InChIKeyJPYIBQBRCSTSAV-UHFFFAOYSA-N
MW3762.91 g/mol
LogP27.05
Rot. Bonds54

About N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (PubChem CID 158989138) has the molecular formula C199H209ClF2N24O33S7 and a molecular weight of 3762.91 g/mol. Its IUPAC name is N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.

Molecular Properties

Compound NameN-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
PubChem CID158989138
Molecular FormulaC199H209ClF2N24O33S7
Molecular Weight3762.91 g/mol
Exact Mass3759.31
IUPAC NameN-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCCOC(=O)CCCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOC(=O)CCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)ccc1O.CCOc1ccccc1CN1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.Cc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(C)c1O.O=C(NCCCCl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2OC(F)F)CC1
InChIInChI=1S/C30H31N3O5S.2C30H31N3O4S.C29H27F2N3O4S.C28H32N4O6S.C27H30N4O6S.C25H27ClN4O4S/c1-2-38-27-19-23(10-13-26(27)34)20-32-15-17-33(18-16-32)30(35)25-11-8-22(9-12-25)21-39(36,37)28-7-3-5-24-6-4-14-31-29(24)28;1-21-17-24(18-22(2)29(21)34)19-32-13-15-33(16-14-32)30(35)26-10-8-23(9-11-26)20-38(36,37)27-7-3-5-25-6-4-12-31-28(25)27;1-2-37-27-10-4-3-7-26(27)21-32-17-19-33(20-18-32)30(34)25-14-12-23(13-15-25)22-38(35,36)28-11-5-8-24-9-6-16-31-29(24)28;30-29(31)38-25-8-2-1-5-24(25)19-33-15-17-34(18-16-33)28(35)23-12-10-21(11-13-23)20-39(36,37)26-9-3-6-22-7-4-14-32-27(22)26;1-2-38-25(33)9-5-15-30-28(35)32-18-16-31(17-19-32)27(34)23-12-10-21(11-13-23)20-39(36,37)24-8-3-6-22-7-4-14-29-26(22)24;1-2-37-24(32)12-14-29-27(34)31-17-15-30(16-18-31)26(33)22-10-8-20(9-11-22)19-38(35,36)23-7-3-5-21-6-4-13-28-25(21)23;26-11-3-13-28-25(32)30-16-14-29(15-17-30)24(31)21-9-7-19(8-10-21)18-35(33,34)22-6-1-4-20-5-2-12-27-23(20)22/h3-14,19,34H,2,15-18,20-21H2,1H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;3-16H,2,17-22H2,1H3;1-14,29H,15-20H2;3-4,6-8,10-14H,2,5,9,15-20H2,1H3,(H,30,35);3-11,13H,2,12,14-19H2,1H3,(H,29,34);1-2,4-10,12H,3,11,13-18H2,(H,28,32)
InChIKeyJPYIBQBRCSTSAV-UHFFFAOYSA-N
XLogP27.05
TPSA702.11 Ų
H-Bond Donors5
H-Bond Acceptors44
Rotatable Bonds54
Heavy Atoms266
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003762.91
LogP ≤ 527.05
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-[[2-[8-[[4-[4-[(3-hydroxy-4-methoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]sulfamoyl]quinolin-6-yl]quinolin-8-yl]sulfonylamino]benzoyl]-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 146755412
N-(4-chlorophenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;N-[2-chloro-5-(trifluoromethyl)phenyl]-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbothioamide;[4-[(3,5-dichloro-2-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,3-dihydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-hydroxy-4-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-(4-methylphenyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide
CID 157071774
[4-(4-Chlorobenzoyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(4-chloro-2,5-difluorobenzoyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-(2-hydroxyethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-pentoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;phenyl-[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[(2,4,5-trimethylphenyl)methyl]piperazin-1-yl]methanone
CID 159086620
[4-[(5-Chloro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-4-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperazin-1-yl]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 159096857
[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
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
[4-[(4-butoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;2-cyclohexylethyl 4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxylate;[4-[(2-hydroxy-3,4-dimethoxy-6-methylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-methyl-4-[4-(pyridine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-methyl-4-[4-(pyridine-3-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone
CID 157364293
[4-[(4-Butylphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-2-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-ethoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-hydroxy-3,4-dimethoxy-6-methylphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 158183331
[4-[(4-Chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,3-dimethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
CID 158827022
N-[4-[4-(2,3-difluorobenzoyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;N-[4-[4-(2,6-difluorobenzoyl)piperazine-1-carbonyl]-2-methylphenyl]quinoline-8-sulfonamide;[4-[(2-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-hydroxy-3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-methyl-4-[4-(pyrazine-2-carbonyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 159328170
[4-[[2-(Difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,4-dimethoxyphenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(5-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-phenylethyl)piperazin-1-yl]methanone
CID 161102517

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The IUPAC name of N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (CID 158989138) is N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.
What is the SMILES notation for N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The canonical SMILES for N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is CCOC(=O)CCCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOC(=O)CCNC(=O)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.CCOc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)ccc1O.CCOc1ccccc1CN1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.Cc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(C)c1O.O=C(NCCCCl)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2OC(F)F)CC1.
What is the InChIKey of N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The InChIKey is JPYIBQBRCSTSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H31N3O5S.2C30H31N3O4S.C29H27F2N3O4S.C28H32N4O6S.C27H30N4O6S.C25H27ClN4O4S/c1-2-38-27-19-23(10-13-26(27)34)20-32-15-17-33(18-16-32)30(35)25-11-8-22(9-12-25)21-39(36,37)28-7-3-5-24-6-4-14-31-29(24)28;1-21-17-24(18-22(2)29(21)34)19-32-13-15-33(16-14-32)30(35)26-10-8-23(9-11-26)20-38(36,37)27-7-3-5-25-6-4-12-31-28(25)27;1-2-37-27-10-4-3-7-26(27)21-32-17-19-33(20-18-32)30(34)25-14-12-23(13-15-25)22-38(35,36)28-11-5-8-24-9-6-16-31-29(24)28;30-29(31)38-25-8-2-1-5-24(25)19-33-15-17-34(18-16-33)28(35)23-12-10-21(11-13-23)20-39(36,37)26-9-3-6-22-7-4-14-32-27(22)26;1-2-38-25(33)9-5-15-30-28(35)32-18-16-31(17-19-32)27(34)23-12-10-21(11-13-23)20-39(36,37)24-8-3-6-22-7-4-14-29-26(22)24;1-2-37-24(32)12-14-29-27(34)31-17-15-30(16-18-31)26(33)22-10-8-20(9-11-22)19-38(35,36)23-7-3-5-21-6-4-13-28-25(21)23;26-11-3-13-28-25(32)30-16-14-29(15-17-30)24(31)21-9-7-19(8-10-21)18-35(33,34)22-6-1-4-20-5-2-12-27-23(20)22/h3-14,19,34H,2,15-18,20-21H2,1H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;3-16H,2,17-22H2,1H3;1-14,29H,15-20H2;3-4,6-8,10-14H,2,5,9,15-20H2,1H3,(H,30,35);3-11,13H,2,12,14-19H2,1H3,(H,29,34);1-2,4-10,12H,3,11,13-18H2,(H,28,32).
What are the key properties of N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone has a molecular weight of 3762.91 g/mol, XLogP of 27.05, 54 rotatable bonds, 5 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropropyl)-4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carboxamide;[4-[[2-(difluoromethoxy)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-ethoxy-4-hydroxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;ethyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]butanoate;ethyl 3-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazine-1-carbonyl]amino]propanoate;[4-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is sourced from PubChem (CID 158989138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).