[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

C208H217N25O35S7 — CID 157364293

IUPAC[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
SMILESCCCCOc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(O)c1OC.COc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(OC)c1O.COc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(OC)c1OC.Cc1cc(C(=O)N2CCN(C(=O)c3ccccn3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(C(=O)c3cccnc3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.O=C(OCCC1CCCCC1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1
InChIInChI=1S/C32H35N3O4S.2C31H33N3O6S.C30H31N3O6S.C30H35N3O5S.2C27H25N5O4S/c1-2-3-22-39-29-15-11-25(12-16-29)23-34-18-20-35(21-19-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-4-6-27-7-5-17-33-31(27)30;1-38-26-14-13-25(29(39-2)30(26)40-3)20-33-16-18-34(19-17-33)31(35)24-11-9-22(10-12-24)21-41(36,37)27-8-4-6-23-7-5-15-32-28(23)27;1-21-18-26(39-2)30(40-3)29(35)25(21)19-33-14-16-34(17-15-33)31(36)24-11-9-22(10-12-24)20-41(37,38)27-8-4-6-23-7-5-13-32-28(23)27;1-38-25-17-22(18-26(39-2)29(25)34)19-32-13-15-33(16-14-32)30(35)24-10-8-21(9-11-24)20-40(36,37)27-7-3-5-23-6-4-12-31-28(23)27;34-29(32-17-19-33(20-18-32)30(35)38-21-15-23-6-2-1-3-7-23)26-13-11-24(12-14-26)22-39(36,37)27-10-4-8-25-9-5-16-31-28(25)27;1-19-17-21(26(33)31-13-15-32(16-14-31)27(34)22-7-3-11-28-18-22)9-10-23(19)30-37(35,36)24-8-2-5-20-6-4-12-29-25(20)24;1-19-18-21(26(33)31-14-16-32(17-15-31)27(34)23-8-2-3-12-28-23)10-11-22(19)30-37(35,36)24-9-4-6-20-7-5-13-29-25(20)24/h4-17H,2-3,18-24H2,1H3;4-15H,16-21H2,1-3H3;4-13,18,35H,14-17,19-20H2,1-3H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;4-5,8-14,16,23H,1-3,6-7,15,17-22H2;2-12,17-18,30H,13-16H2,1H3;2-13,18,30H,14-17H2,1H3
InChIKeyBIZQXLKJDZKTLB-UHFFFAOYSA-N
MW3851.63 g/mol
LogP29.37
Rot. Bonds52

About [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

[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 (PubChem CID 157364293) has the molecular formula C208H217N25O35S7 and a molecular weight of 3851.63 g/mol. Its IUPAC name is [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.

Molecular Properties

Compound Name[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
PubChem CID157364293
Molecular FormulaC208H217N25O35S7
Molecular Weight3851.63 g/mol
Exact Mass3848.40
IUPAC Name[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
SMILESCCCCOc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(O)c1OC.COc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(OC)c1O.COc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(OC)c1OC.Cc1cc(C(=O)N2CCN(C(=O)c3ccccn3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(C(=O)c3cccnc3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.O=C(OCCC1CCCCC1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1
InChIInChI=1S/C32H35N3O4S.2C31H33N3O6S.C30H31N3O6S.C30H35N3O5S.2C27H25N5O4S/c1-2-3-22-39-29-15-11-25(12-16-29)23-34-18-20-35(21-19-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-4-6-27-7-5-17-33-31(27)30;1-38-26-14-13-25(29(39-2)30(26)40-3)20-33-16-18-34(19-17-33)31(35)24-11-9-22(10-12-24)21-41(36,37)27-8-4-6-23-7-5-15-32-28(23)27;1-21-18-26(39-2)30(40-3)29(35)25(21)19-33-14-16-34(17-15-33)31(36)24-11-9-22(10-12-24)20-41(37,38)27-8-4-6-23-7-5-13-32-28(23)27;1-38-25-17-22(18-26(39-2)29(25)34)19-32-13-15-33(16-14-32)30(35)24-10-8-21(9-11-24)20-40(36,37)27-7-3-5-23-6-4-12-31-28(23)27;34-29(32-17-19-33(20-18-32)30(35)38-21-15-23-6-2-1-3-7-23)26-13-11-24(12-14-26)22-39(36,37)27-10-4-8-25-9-5-16-31-28(25)27;1-19-17-21(26(33)31-13-15-32(16-14-31)27(34)22-7-3-11-28-18-22)9-10-23(19)30-37(35,36)24-8-2-5-20-6-4-12-29-25(20)24;1-19-18-21(26(33)31-14-16-32(17-15-31)27(34)23-8-2-3-12-28-23)10-11-22(19)30-37(35,36)24-9-4-6-20-7-5-13-29-25(20)24/h4-17H,2-3,18-24H2,1H3;4-15H,16-21H2,1-3H3;4-13,18,35H,14-17,19-20H2,1-3H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;4-5,8-14,16,23H,1-3,6-7,15,17-22H2;2-12,17-18,30H,13-16H2,1H3;2-13,18,30H,14-17H2,1H3
InChIKeyBIZQXLKJDZKTLB-UHFFFAOYSA-N
XLogP29.37
TPSA718.64 Ų
H-Bond Donors4
H-Bond Acceptors48
Rotatable Bonds52
Heavy Atoms275
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003851.63
LogP ≤ 529.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

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

Analyze [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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of [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?
The IUPAC name of [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) is [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.
What is the SMILES notation for [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?
The canonical SMILES for [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 is CCCCOc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(O)c1OC.COc1cc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc(OC)c1O.COc1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c(OC)c1OC.Cc1cc(C(=O)N2CCN(C(=O)c3ccccn3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.Cc1cc(C(=O)N2CCN(C(=O)c3cccnc3)CC2)ccc1NS(=O)(=O)c1cccc2cccnc12.O=C(OCCC1CCCCC1)N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.
What is the InChIKey of [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?
The InChIKey is BIZQXLKJDZKTLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H35N3O4S.2C31H33N3O6S.C30H31N3O6S.C30H35N3O5S.2C27H25N5O4S/c1-2-3-22-39-29-15-11-25(12-16-29)23-34-18-20-35(21-19-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-4-6-27-7-5-17-33-31(27)30;1-38-26-14-13-25(29(39-2)30(26)40-3)20-33-16-18-34(19-17-33)31(35)24-11-9-22(10-12-24)21-41(36,37)27-8-4-6-23-7-5-15-32-28(23)27;1-21-18-26(39-2)30(40-3)29(35)25(21)19-33-14-16-34(17-15-33)31(36)24-11-9-22(10-12-24)20-41(37,38)27-8-4-6-23-7-5-13-32-28(23)27;1-38-25-17-22(18-26(39-2)29(25)34)19-32-13-15-33(16-14-32)30(35)24-10-8-21(9-11-24)20-40(36,37)27-7-3-5-23-6-4-12-31-28(23)27;34-29(32-17-19-33(20-18-32)30(35)38-21-15-23-6-2-1-3-7-23)26-13-11-24(12-14-26)22-39(36,37)27-10-4-8-25-9-5-16-31-28(25)27;1-19-17-21(26(33)31-13-15-32(16-14-31)27(34)22-7-3-11-28-18-22)9-10-23(19)30-37(35,36)24-8-2-5-20-6-4-12-29-25(20)24;1-19-18-21(26(33)31-14-16-32(17-15-31)27(34)23-8-2-3-12-28-23)10-11-22(19)30-37(35,36)24-9-4-6-20-7-5-13-29-25(20)24/h4-17H,2-3,18-24H2,1H3;4-15H,16-21H2,1-3H3;4-13,18,35H,14-17,19-20H2,1-3H3;3-12,17-18,34H,13-16,19-20H2,1-2H3;4-5,8-14,16,23H,1-3,6-7,15,17-22H2;2-12,17-18,30H,13-16H2,1H3;2-13,18,30H,14-17H2,1H3.
What are the key properties of [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?
[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 has a molecular weight of 3851.63 g/mol, XLogP of 29.37, 52 rotatable bonds, 4 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for [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 is sourced from PubChem (CID 157364293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).