(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

C251H238Cl4F6N28O27S9 — CID 158424945

IUPAC(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCc1cc(C(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccc(F)c(Cl)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(CC2CC2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2c(F)cccc2F)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccncc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1Cl)N1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C29H27ClFN3O3S.C29H27F2N3O3S.C29H29N3O3S.C28H25ClFN3O3S.C28H26ClN3O3S.C28H25F2N3O3S.C28H27N3O3S.C27H25ClN4O3S.C25H27N3O3S/c1-20-16-23(29(35)34-14-12-33(13-15-34)18-21-7-10-26(31)25(30)17-21)8-9-24(20)19-38(36,37)27-6-2-4-22-5-3-11-32-28(22)27;1-20-14-23(29(35)34-12-10-33(11-13-34)18-21-15-25(30)17-26(31)16-21)7-8-24(20)19-38(36,37)27-6-2-4-22-5-3-9-32-28(22)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;29-24-11-8-21(17-25(24)30)18-32-13-15-33(16-14-32)28(34)23-9-6-20(7-10-23)19-37(35,36)26-5-1-3-22-4-2-12-31-27(22)26;29-25-18-22(20-36(34,35)26-10-4-8-23-9-5-13-30-27(23)26)11-12-24(25)28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21;29-24-6-2-7-25(30)23(24)18-32-14-16-33(17-15-32)28(34)22-11-9-20(10-12-22)19-37(35,36)26-8-1-4-21-5-3-13-31-27(21)26;32-28(31-18-16-30(17-19-31)20-22-6-2-1-3-7-22)25-13-11-23(12-14-25)21-35(33,34)26-10-4-8-24-9-5-15-29-27(24)26;28-24-17-29-12-10-23(24)18-31-13-15-32(16-14-31)27(33)22-8-6-20(7-9-22)19-36(34,35)25-5-1-3-21-4-2-11-30-26(21)25;29-25(28-15-13-27(14-16-28)17-19-6-7-19)22-10-8-20(9-11-22)18-32(30,31)23-5-1-3-21-4-2-12-26-24(21)23/h2-11,16-17H,12-15,18-19H2,1H3;2-9,14-17H,10-13,18-19H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-12,17H,13-16,18-19H2;1-13,18H,14-17,19-20H2;1-13H,14-19H2;1-15H,16-21H2;1-12,17H,13-16,18-19H2;1-5,8-12,19H,6-7,13-18H2
InChIKeyHAXXZDGMHKXMIZ-UHFFFAOYSA-N
MW4623.24 g/mol
LogP40.48
Rot. Bonds54

About (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (PubChem CID 158424945) has the molecular formula C251H238Cl4F6N28O27S9 and a molecular weight of 4623.24 g/mol. Its IUPAC name is (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.

Molecular Properties

Compound Name(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
PubChem CID158424945
Molecular FormulaC251H238Cl4F6N28O27S9
Molecular Weight4623.24 g/mol
Exact Mass4617.43
IUPAC Name(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCc1cc(C(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccc(F)c(Cl)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(CC2CC2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2c(F)cccc2F)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccncc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1Cl)N1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C29H27ClFN3O3S.C29H27F2N3O3S.C29H29N3O3S.C28H25ClFN3O3S.C28H26ClN3O3S.C28H25F2N3O3S.C28H27N3O3S.C27H25ClN4O3S.C25H27N3O3S/c1-20-16-23(29(35)34-14-12-33(13-15-34)18-21-7-10-26(31)25(30)17-21)8-9-24(20)19-38(36,37)27-6-2-4-22-5-3-11-32-28(22)27;1-20-14-23(29(35)34-12-10-33(11-13-34)18-21-15-25(30)17-26(31)16-21)7-8-24(20)19-38(36,37)27-6-2-4-22-5-3-9-32-28(22)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;29-24-11-8-21(17-25(24)30)18-32-13-15-33(16-14-32)28(34)23-9-6-20(7-10-23)19-37(35,36)26-5-1-3-22-4-2-12-31-27(22)26;29-25-18-22(20-36(34,35)26-10-4-8-23-9-5-13-30-27(23)26)11-12-24(25)28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21;29-24-6-2-7-25(30)23(24)18-32-14-16-33(17-15-32)28(34)22-11-9-20(10-12-22)19-37(35,36)26-8-1-4-21-5-3-13-31-27(21)26;32-28(31-18-16-30(17-19-31)20-22-6-2-1-3-7-22)25-13-11-23(12-14-25)21-35(33,34)26-10-4-8-24-9-5-15-29-27(24)26;28-24-17-29-12-10-23(24)18-31-13-15-32(16-14-31)27(33)22-8-6-20(7-9-22)19-36(34,35)25-5-1-3-21-4-2-11-30-26(21)25;29-25(28-15-13-27(14-16-28)17-19-6-7-19)22-10-8-20(9-11-22)18-32(30,31)23-5-1-3-21-4-2-12-26-24(21)23/h2-11,16-17H,12-15,18-19H2,1H3;2-9,14-17H,10-13,18-19H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-12,17H,13-16,18-19H2;1-13,18H,14-17,19-20H2;1-13H,14-19H2;1-15H,16-21H2;1-12,17H,13-16,18-19H2;1-5,8-12,19H,6-7,13-18H2
InChIKeyHAXXZDGMHKXMIZ-UHFFFAOYSA-N
XLogP40.48
TPSA648.11 Ų
H-Bond Donors
H-Bond Acceptors46
Rotatable Bonds54
Heavy Atoms325
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004623.24
LogP ≤ 540.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1046

Analyze (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone with MolForge

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Related Compounds

[4-[(4-Chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 59634791
[4-[(4-Chloro-2-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 146808934
[4-[(3-Chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 147632769
(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[2-fluoro-4-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-[2-(4-fluorophenyl)acetyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[2-fluoro-4-[4-(2-phenylacetyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
CID 157273980
(4-Butylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-dichlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
CID 160399032
[4-[(3-Chloro-4-pyridinyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 59634915
[4-[(5-Chloro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 59635210
[4-[(2,4-Dichlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 148377220
7-(Aminomethyl)-6-methylnaphthalen-1-amine;8-amino-3-methylnaphthalene-2-carboxamide;8-amino-3-methylnaphthalene-2-sulfonamide;1-chloro-6-fluoro-7-methylnaphthalene;6-chloro-7-methylisoquinoline;7-chloro-6-methylisoquinoline;7-chloro-6-methylnaphthalen-1-amine;1,6-dichloro-7-methylnaphthalene;6-fluoro-7-methylisoquinoline;7-fluoro-6-methylisoquinoline;6-methylisoquinoline-7-carboxamide;7-methylisoquinoline-6-carboxamide;6-methylisoquinoline-7-sulfonamide;7-methylisoquinoline-6-sulfonamide;(6-methylisoquinolin-7-yl)methanamine;(7-methylisoquinolin-6-yl)methanamine;6-methyl-7-methylsulfonylisoquinoline;7-methyl-6-methylsulfonylisoquinoline;6-methyl-7-methylsulfonylnaphthalen-1-amine;2-methyl-3-methylsulfonylnaphthalene;3-methylnaphthalene-2-sulfonamide;7-methylquinoline
CID 157346626
2-chloro-N-methyl-4-(2-propan-2-yl-3-pyridinyl)benzamide;1-[2-chloro-5-(2-propan-2-yl-3-pyridinyl)phenyl]ethenamine;3-(3,4-difluorophenyl)-2-propan-2-ylpyridine;3-(4-fluoro-2-methylphenyl)-2-propan-2-ylpyridine;2-fluoro-3-methyl-5-(2-propan-2-yl-3-pyridinyl)pyridine;1-[2-fluoro-5-(2-propan-2-yl-3-pyridinyl)phenyl]-3,3-dimethylbutan-1-one;3-(4-methylsulfonylphenyl)-2-propan-2-ylpyridine;3-naphthalen-1-yl-2-propan-2-ylpyridine;3-(4-phenylphenyl)-2-propan-2-ylpyridine;5-(2-propan-2-yl-3-pyridinyl)isoquinoline;6-(2-propan-2-yl-3-pyridinyl)quinoline;6-(2-propan-2-yl-3-pyridinyl)quinoxaline
CID 157742431
[4-[(3-Chlorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,3-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone;[4-(pyridin-3-ylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(pyridin-4-ylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 157840513
[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[(2S)-4-(cyclopropylmethyl)-2-methylpiperazin-1-yl]methanone;[(2S)-4-[1-(3,5-difluorophenyl)ethyl]-2-methylpiperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;N-[4-[(2S)-4-[(3,5-difluorophenyl)methyl]-2-phenylpiperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;N-[4-[(2S)-2-methyl-4-[1-(2,3,4-trifluorophenyl)ethyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide;[(3R)-oxolan-3-yl] (3S)-3-methyl-4-[4-(quinolin-8-ylsulfonylamino)benzoyl]piperazine-1-carboxylate
CID 158135495

Frequently Asked Questions

What is the IUPAC name of (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The IUPAC name of (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (CID 158424945) is (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.
What is the SMILES notation for (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The canonical SMILES for (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is Cc1cc(C(=O)N2CCN(Cc3cc(F)cc(F)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccc(F)c(Cl)c3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(CC2CC2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2c(F)cccc2F)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccncc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1Cl)N1CCN(Cc2ccccc2)CC1.
What is the InChIKey of (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The InChIKey is HAXXZDGMHKXMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27ClFN3O3S.C29H27F2N3O3S.C29H29N3O3S.C28H25ClFN3O3S.C28H26ClN3O3S.C28H25F2N3O3S.C28H27N3O3S.C27H25ClN4O3S.C25H27N3O3S/c1-20-16-23(29(35)34-14-12-33(13-15-34)18-21-7-10-26(31)25(30)17-21)8-9-24(20)19-38(36,37)27-6-2-4-22-5-3-11-32-28(22)27;1-20-14-23(29(35)34-12-10-33(11-13-34)18-21-15-25(30)17-26(31)16-21)7-8-24(20)19-38(36,37)27-6-2-4-22-5-3-9-32-28(22)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;29-24-11-8-21(17-25(24)30)18-32-13-15-33(16-14-32)28(34)23-9-6-20(7-10-23)19-37(35,36)26-5-1-3-22-4-2-12-31-27(22)26;29-25-18-22(20-36(34,35)26-10-4-8-23-9-5-13-30-27(23)26)11-12-24(25)28(33)32-16-14-31(15-17-32)19-21-6-2-1-3-7-21;29-24-6-2-7-25(30)23(24)18-32-14-16-33(17-15-32)28(34)22-11-9-20(10-12-22)19-37(35,36)26-8-1-4-21-5-3-13-31-27(21)26;32-28(31-18-16-30(17-19-31)20-22-6-2-1-3-7-22)25-13-11-23(12-14-25)21-35(33,34)26-10-4-8-24-9-5-15-29-27(24)26;28-24-17-29-12-10-23(24)18-31-13-15-32(16-14-31)27(33)22-8-6-20(7-9-22)19-36(34,35)25-5-1-3-21-4-2-11-30-26(21)25;29-25(28-15-13-27(14-16-28)17-19-6-7-19)22-10-8-20(9-11-22)18-32(30,31)23-5-1-3-21-4-2-12-26-24(21)23/h2-11,16-17H,12-15,18-19H2,1H3;2-9,14-17H,10-13,18-19H2,1H3;2-14,19H,15-18,20-21H2,1H3;1-12,17H,13-16,18-19H2;1-13,18H,14-17,19-20H2;1-13H,14-19H2;1-15H,16-21H2;1-12,17H,13-16,18-19H2;1-5,8-12,19H,6-7,13-18H2.
What are the key properties of (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
(4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone has a molecular weight of 4623.24 g/mol, XLogP of 40.48, 54 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylpiperazin-1-yl)-[2-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-benzylpiperazin-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-chloro-3-fluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-chloro-4-pyridinyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(cyclopropylmethyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,6-difluorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is sourced from PubChem (CID 158424945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).