N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

C205H207ClN22O26S7 — CID 161345842

IUPACN-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCCCOc1ccc(CN2CCCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C(=O)N2CCCN(c3ccccc3OC)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(Cl)c2)CC1.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(c2ccccc2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1
InChIInChI=1S/C32H35N3O4S.C30H31N3O5S.C29H28ClN3O4S.C29H29N3O4S.C29H29N3O3S.C28H28N4O3S.C28H27N3O3S/c1-2-22-39-29-15-11-25(12-16-29)23-34-18-5-19-35(21-20-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-3-6-27-7-4-17-33-31(27)30;1-37-26-11-4-3-10-25(26)32-16-7-17-33(19-18-32)30(34)23-13-14-24(27(20-23)38-2)21-39(35,36)28-12-5-8-22-9-6-15-31-29(22)28;1-37-26-10-3-2-9-25(26)32-15-6-16-33(18-17-32)29(34)22-12-13-23(24(30)19-22)20-38(35,36)27-11-4-7-21-8-5-14-31-28(21)27;1-36-26-10-3-2-9-25(26)31-17-6-18-32(20-19-31)29(33)24-14-12-22(13-15-24)21-37(34,35)27-11-4-7-23-8-5-16-30-28(23)27;33-29(32-18-6-17-31(19-20-32)21-23-7-2-1-3-8-23)26-14-12-24(13-15-26)22-36(34,35)27-11-4-9-25-10-5-16-30-28(25)27;33-28(32-18-6-17-31(19-20-32)21-22-7-2-1-3-8-22)24-12-14-25(15-13-24)30-36(34,35)26-11-4-9-23-10-5-16-29-27(23)26;32-28(31-18-6-17-30(19-20-31)25-9-2-1-3-10-25)24-14-12-22(13-15-24)21-35(33,34)26-11-4-7-23-8-5-16-29-27(23)26/h3-4,6-17H,2,5,18-24H2,1H3;3-6,8-15,20H,7,16-19,21H2,1-2H3;2-5,7-14,19H,6,15-18,20H2,1H3;2-5,7-16H,6,17-21H2,1H3;1-5,7-16H,6,17-22H2;1-5,7-16,30H,6,17-21H2;1-5,7-16H,6,17-21H2
InChIKeyVNGVSOZWCUGVJQ-UHFFFAOYSA-N
MW3654.96 g/mol
LogP33.22
Rot. Bonds45

About N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone

N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (PubChem CID 161345842) has the molecular formula C205H207ClN22O26S7 and a molecular weight of 3654.96 g/mol. Its IUPAC name is N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.

Molecular Properties

Compound NameN-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
PubChem CID161345842
Molecular FormulaC205H207ClN22O26S7
Molecular Weight3654.96 g/mol
Exact Mass3651.33
IUPAC NameN-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
SMILESCCCOc1ccc(CN2CCCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C(=O)N2CCCN(c3ccccc3OC)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(Cl)c2)CC1.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(c2ccccc2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1
InChIInChI=1S/C32H35N3O4S.C30H31N3O5S.C29H28ClN3O4S.C29H29N3O4S.C29H29N3O3S.C28H28N4O3S.C28H27N3O3S/c1-2-22-39-29-15-11-25(12-16-29)23-34-18-5-19-35(21-20-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-3-6-27-7-4-17-33-31(27)30;1-37-26-11-4-3-10-25(26)32-16-7-17-33(19-18-32)30(34)23-13-14-24(27(20-23)38-2)21-39(35,36)28-12-5-8-22-9-6-15-31-29(22)28;1-37-26-10-3-2-9-25(26)32-15-6-16-33(18-17-32)29(34)22-12-13-23(24(30)19-22)20-38(35,36)27-11-4-7-21-8-5-14-31-28(21)27;1-36-26-10-3-2-9-25(26)31-17-6-18-32(20-19-31)29(33)24-14-12-22(13-15-24)21-37(34,35)27-11-4-7-23-8-5-16-30-28(23)27;33-29(32-18-6-17-31(19-20-32)21-23-7-2-1-3-8-23)26-14-12-24(13-15-26)22-36(34,35)27-11-4-9-25-10-5-16-30-28(25)27;33-28(32-18-6-17-31(19-20-32)21-22-7-2-1-3-8-22)24-12-14-25(15-13-24)30-36(34,35)26-11-4-9-23-10-5-16-29-27(23)26;32-28(31-18-6-17-30(19-20-31)25-9-2-1-3-10-25)24-14-12-22(13-15-24)21-35(33,34)26-11-4-7-23-8-5-16-29-27(23)26/h3-4,6-17H,2,5,18-24H2,1H3;3-6,8-15,20H,7,16-19,21H2,1-2H3;2-5,7-14,19H,6,15-18,20H2,1H3;2-5,7-16H,6,17-21H2,1H3;1-5,7-16H,6,17-22H2;1-5,7-16,30H,6,17-21H2;1-5,7-16H,6,17-21H2
InChIKeyVNGVSOZWCUGVJQ-UHFFFAOYSA-N
XLogP33.22
TPSA552.24 Ų
H-Bond Donors1
H-Bond Acceptors40
Rotatable Bonds45
Heavy Atoms261
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003654.96
LogP ≤ 533.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1040

Analyze N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone with MolForge

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Related Compounds

N-[4-[4-[(4-pentoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59634878
[4-(2-methoxyphenyl)piperazin-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 158170125
N-[4-[4-[(2-propoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59634956
N-[4-[4-[(2-fluoro-6-methoxyphenyl)methyl]-1,4-diazepane-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635207
N-[4-[4-[(3-hydroxy-4-methoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635008
N-[4-[4-(2-ethylphenyl)piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635273
N-[4-[4-[(2-fluoro-4-methoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59635075
[4-[(2-ethylphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 148859589
N-[4-[4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane-1-carbonyl]phenyl]quinoline-8-sulfonamide
CID 59634872
[4-[(3,5-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone
CID 148989727
N-[4-[4-[(2,4-dimethoxyphenyl)methyl]piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide
CID 67504817
N-[4-[4-[(3,5-dichlorophenyl)methyl]piperazine-1-carbonyl]-2-methoxyphenyl]quinoline-8-sulfonamide
CID 67504938

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The IUPAC name of N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone (CID 161345842) is N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone.
What is the SMILES notation for N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The canonical SMILES for N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is CCCOc1ccc(CN2CCCN(C(=O)c3ccc(CS(=O)(=O)c4cccc5cccnc45)cc3)CC2)cc1.COc1cc(C(=O)N2CCCN(c3ccccc3OC)CC2)ccc1CS(=O)(=O)c1cccc2cccnc12.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)c(Cl)c2)CC1.COc1ccccc1N1CCCN(C(=O)c2ccc(CS(=O)(=O)c3cccc4cccnc34)cc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1.O=C(c1ccc(CS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(c2ccccc2)CC1.O=C(c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1)N1CCCN(Cc2ccccc2)CC1.
What is the InChIKey of N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
The InChIKey is VNGVSOZWCUGVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H35N3O4S.C30H31N3O5S.C29H28ClN3O4S.C29H29N3O4S.C29H29N3O3S.C28H28N4O3S.C28H27N3O3S/c1-2-22-39-29-15-11-25(12-16-29)23-34-18-5-19-35(21-20-34)32(36)28-13-9-26(10-14-28)24-40(37,38)30-8-3-6-27-7-4-17-33-31(27)30;1-37-26-11-4-3-10-25(26)32-16-7-17-33(19-18-32)30(34)23-13-14-24(27(20-23)38-2)21-39(35,36)28-12-5-8-22-9-6-15-31-29(22)28;1-37-26-10-3-2-9-25(26)32-15-6-16-33(18-17-32)29(34)22-12-13-23(24(30)19-22)20-38(35,36)27-11-4-7-21-8-5-14-31-28(21)27;1-36-26-10-3-2-9-25(26)31-17-6-18-32(20-19-31)29(33)24-14-12-22(13-15-24)21-37(34,35)27-11-4-7-23-8-5-16-30-28(23)27;33-29(32-18-6-17-31(19-20-32)21-23-7-2-1-3-8-23)26-14-12-24(13-15-26)22-36(34,35)27-11-4-9-25-10-5-16-30-28(25)27;33-28(32-18-6-17-31(19-20-32)21-22-7-2-1-3-8-22)24-12-14-25(15-13-24)30-36(34,35)26-11-4-9-23-10-5-16-29-27(23)26;32-28(31-18-6-17-30(19-20-31)25-9-2-1-3-10-25)24-14-12-22(13-15-24)21-35(33,34)26-11-4-7-23-8-5-16-29-27(23)26/h3-4,6-17H,2,5,18-24H2,1H3;3-6,8-15,20H,7,16-19,21H2,1-2H3;2-5,7-14,19H,6,15-18,20H2,1H3;2-5,7-16H,6,17-21H2,1H3;1-5,7-16H,6,17-22H2;1-5,7-16,30H,6,17-21H2;1-5,7-16H,6,17-21H2.
What are the key properties of N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone?
N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone has a molecular weight of 3654.96 g/mol, XLogP of 33.22, 45 rotatable bonds, 1 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-benzyl-1,4-diazepane-1-carbonyl)phenyl]quinoline-8-sulfonamide;(4-benzyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[3-chloro-4-(quinolin-8-ylsulfonylmethyl)phenyl]-[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[3-methoxy-4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;(4-phenyl-1,4-diazepan-1-yl)-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone;[4-[(4-propoxyphenyl)methyl]-1,4-diazepan-1-yl]-[4-(quinolin-8-ylsulfonylmethyl)phenyl]methanone is sourced from PubChem (CID 161345842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).