[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

C195H185Cl2F4N23O24S9 — CID 160804881

IUPAC[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESCOC(=O)c1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1ccccc1N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(C)c2)CC1.Cc1ccc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.Cc1cnc(N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)s1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(C(F)(F)F)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)cc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(c2nccs2)CC1
InChIInChI=1S/C30H29N3O5S.C30H31N3O3S.C29H25F4N3O3S.C29H29N3O4S.C28H25Cl2N3O3S.C25H24N4O3S2.C24H22N4O3S2/c1-38-30(35)26-13-7-22(8-14-26)20-32-16-18-33(19-17-32)29(34)25-11-9-23(10-12-25)21-39(36,37)27-6-2-4-24-5-3-15-31-28(24)27;1-22-8-9-23(2)27(19-22)20-32-15-17-33(18-16-32)30(34)26-12-10-24(11-13-26)21-37(35,36)28-7-3-5-25-6-4-14-31-29(25)28;30-25-17-21(8-11-24(25)29(31,32)33)18-35-13-15-36(16-14-35)28(37)23-9-6-20(7-10-23)19-40(38,39)26-5-1-3-22-4-2-12-34-27(22)26;1-21-19-23(29(33)32-17-15-31(16-18-32)25-9-3-4-10-26(25)36-2)12-13-24(21)20-37(34,35)27-11-5-7-22-8-6-14-30-28(22)27;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;1-18-16-27-25(33-18)29-14-12-28(13-15-29)24(30)21-9-7-19(8-10-21)17-34(31,32)22-6-2-4-20-5-3-11-26-23(20)22;29-23(27-12-14-28(15-13-27)24-26-11-16-32-24)20-8-6-18(7-9-20)17-33(30,31)21-5-1-3-19-4-2-10-25-22(19)21/h2-15H,16-21H2,1H3;3-14,19H,15-18,20-21H2,1-2H3;1-12,17H,13-16,18-19H2;3-14,19H,15-18,20H2,1-2H3;1-12,17H,13-16,18-19H2;2-11,16H,12-15,17H2,1H3;1-11,16H,12-15,17H2
InChIKeySDOCRUMBRRQJAF-UHFFFAOYSA-N
MW3670.26 g/mol
LogP31.59
Rot. Bonds41

About [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone (PubChem CID 160804881) has the molecular formula C195H185Cl2F4N23O24S9 and a molecular weight of 3670.26 g/mol. Its IUPAC name is [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
PubChem CID160804881
Molecular FormulaC195H185Cl2F4N23O24S9
Molecular Weight3670.26 g/mol
Exact Mass3666.08
IUPAC Name[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESCOC(=O)c1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1ccccc1N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(C)c2)CC1.Cc1ccc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.Cc1cnc(N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)s1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(C(F)(F)F)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)cc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(c2nccs2)CC1
InChIInChI=1S/C30H29N3O5S.C30H31N3O3S.C29H25F4N3O3S.C29H29N3O4S.C28H25Cl2N3O3S.C25H24N4O3S2.C24H22N4O3S2/c1-38-30(35)26-13-7-22(8-14-26)20-32-16-18-33(19-17-32)29(34)25-11-9-23(10-12-25)21-39(36,37)27-6-2-4-24-5-3-15-31-28(24)27;1-22-8-9-23(2)27(19-22)20-32-15-17-33(18-16-32)30(34)26-12-10-24(11-13-26)21-37(35,36)28-7-3-5-25-6-4-14-31-29(25)28;30-25-17-21(8-11-24(25)29(31,32)33)18-35-13-15-36(16-14-35)28(37)23-9-6-20(7-10-23)19-40(38,39)26-5-1-3-22-4-2-12-34-27(22)26;1-21-19-23(29(33)32-17-15-31(16-18-32)25-9-3-4-10-26(25)36-2)12-13-24(21)20-37(34,35)27-11-5-7-22-8-6-14-30-28(22)27;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;1-18-16-27-25(33-18)29-14-12-28(13-15-29)24(30)21-9-7-19(8-10-21)17-34(31,32)22-6-2-4-20-5-3-11-26-23(20)22;29-23(27-12-14-28(15-13-27)24-26-11-16-32-24)20-8-6-18(7-9-20)17-33(30,31)21-5-1-3-19-4-2-10-25-22(19)21/h2-15H,16-21H2,1H3;3-14,19H,15-18,20-21H2,1-2H3;1-12,17H,13-16,18-19H2;3-14,19H,15-18,20H2,1-2H3;1-12,17H,13-16,18-19H2;2-11,16H,12-15,17H2,1H3;1-11,16H,12-15,17H2
InChIKeySDOCRUMBRRQJAF-UHFFFAOYSA-N
XLogP31.59
TPSA555.37 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds41
Heavy Atoms257
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003670.26
LogP ≤ 531.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone with MolForge

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Related Compounds

[4-[(5-Chloro-3-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(3-fluoro-2-pyridinyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-fluoro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone;[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxy-3-pyridinyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(3-methoxy-2-pyridinyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone
CID 158546174

Frequently Asked Questions

What is the IUPAC name of [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone (CID 160804881) is [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone is COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1ccccc1N1CCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(C)c2)CC1.Cc1ccc(C)c(CN2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)c1.Cc1cnc(N2CCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)s1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(C(F)(F)F)c(F)c2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(Cc2ccc(Cl)cc2Cl)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCN(c2nccs2)CC1.
What is the InChIKey of [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is SDOCRUMBRRQJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N3O5S.C30H31N3O3S.C29H25F4N3O3S.C29H29N3O4S.C28H25Cl2N3O3S.C25H24N4O3S2.C24H22N4O3S2/c1-38-30(35)26-13-7-22(8-14-26)20-32-16-18-33(19-17-32)29(34)25-11-9-23(10-12-25)21-39(36,37)27-6-2-4-24-5-3-15-31-28(24)27;1-22-8-9-23(2)27(19-22)20-32-15-17-33(18-16-32)30(34)26-12-10-24(11-13-26)21-37(35,36)28-7-3-5-25-6-4-14-31-29(25)28;30-25-17-21(8-11-24(25)29(31,32)33)18-35-13-15-36(16-14-35)28(37)23-9-6-20(7-10-23)19-40(38,39)26-5-1-3-22-4-2-12-34-27(22)26;1-21-19-23(29(33)32-17-15-31(16-18-32)25-9-3-4-10-26(25)36-2)12-13-24(21)20-37(34,35)27-11-5-7-22-8-6-14-30-28(22)27;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;1-18-16-27-25(33-18)29-14-12-28(13-15-29)24(30)21-9-7-19(8-10-21)17-34(31,32)22-6-2-4-20-5-3-11-26-23(20)22;29-23(27-12-14-28(15-13-27)24-26-11-16-32-24)20-8-6-18(7-9-20)17-33(30,31)21-5-1-3-19-4-2-10-25-22(19)21/h2-15H,16-21H2,1H3;3-14,19H,15-18,20-21H2,1-2H3;1-12,17H,13-16,18-19H2;3-14,19H,15-18,20H2,1-2H3;1-12,17H,13-16,18-19H2;2-11,16H,12-15,17H2,1H3;1-11,16H,12-15,17H2.
What are the key properties of [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone?
[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 3670.26 g/mol, XLogP of 31.59, 41 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(2,5-dimethylphenyl)methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)piperazin-1-yl]-[3-methyl-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;methyl 4-[[4-[4-(quinolin-8-ylsulfonylmethyl)benzoyl]piperazin-1-yl]methyl]benzoate;[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 160804881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).