13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

C139H160N14O17S — CID 162169464

IUPAC13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
SMILESC.CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3.COC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(NC(C)=O)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(C(=O)N2CCCC2)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3
InChIInChI=1S/C36H43N5O5S.C35H39N3O4.C34H37N3O4.C33H37N3O4.CH4/c1-38(2)47(45,46)37-35(43)26-14-15-30-31(22-26)41-23-27(36(44)39-19-16-28(17-20-39)40-18-8-13-32(40)42)21-25-11-6-7-12-29(25)34(41)33(30)24-9-4-3-5-10-24;39-33(36-16-6-7-17-36)24-14-18-37(19-15-24)34(40)27-20-25-10-4-5-11-28(25)32-31(23-8-2-1-3-9-23)29-13-12-26(35(41)42)21-30(29)38(32)22-27;38-30-11-6-16-36(30)26-14-17-35(18-15-26)33(39)25-19-23-9-4-5-10-27(23)32-31(22-7-2-1-3-8-22)28-13-12-24(34(40)41)20-29(28)37(32)21-25;1-21(37)34-26-14-16-35(17-15-26)32(38)25-18-23-10-6-7-11-27(23)31-30(22-8-4-3-5-9-22)28-13-12-24(33(39)40-2)19-29(28)36(31)20-25;/h6-7,11-12,14-15,21-22,24,28H,3-5,8-10,13,16-20,23H2,1-2H3,(H,37,43);4-5,10-13,20-21,23-24H,1-3,6-9,14-19,22H2,(H,41,42);4-5,9-10,12-13,19-20,22,26H,1-3,6-8,11,14-18,21H2,(H,40,41);6-7,10-13,18-19,22,26H,3-5,8-9,14-17,20H2,1-2H3,(H,34,37);1H4
InChIKeyZNOXBYUXPKAGPS-UHFFFAOYSA-N
MW2330.96 g/mol
LogP23.58
Rot. Bonds18

About 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate

13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate (PubChem CID 162169464) has the molecular formula C139H160N14O17S and a molecular weight of 2330.96 g/mol. Its IUPAC name is 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate.

Molecular Properties

Compound Name13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
PubChem CID162169464
Molecular FormulaC139H160N14O17S
Molecular Weight2330.96 g/mol
Exact Mass2329.18
IUPAC Name13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
SMILESC.CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3.COC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(NC(C)=O)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(C(=O)N2CCCC2)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3
InChIInChI=1S/C36H43N5O5S.C35H39N3O4.C34H37N3O4.C33H37N3O4.CH4/c1-38(2)47(45,46)37-35(43)26-14-15-30-31(22-26)41-23-27(36(44)39-19-16-28(17-20-39)40-18-8-13-32(40)42)21-25-11-6-7-12-29(25)34(41)33(30)24-9-4-3-5-10-24;39-33(36-16-6-7-17-36)24-14-18-37(19-15-24)34(40)27-20-25-10-4-5-11-28(25)32-31(23-8-2-1-3-9-23)29-13-12-26(35(41)42)21-30(29)38(32)22-27;38-30-11-6-16-36(30)26-14-17-35(18-15-26)33(39)25-19-23-9-4-5-10-27(23)32-31(22-7-2-1-3-8-22)28-13-12-24(34(40)41)20-29(28)37(32)21-25;1-21(37)34-26-14-16-35(17-15-26)32(38)25-18-23-10-6-7-11-27(23)31-30(22-8-4-3-5-9-22)28-13-12-24(33(39)40-2)19-29(28)36(31)20-25;/h6-7,11-12,14-15,21-22,24,28H,3-5,8-10,13,16-20,23H2,1-2H3,(H,37,43);4-5,10-13,20-21,23-24H,1-3,6-9,14-19,22H2,(H,41,42);4-5,9-10,12-13,19-20,22,26H,1-3,6-8,11,14-18,21H2,(H,40,41);6-7,10-13,18-19,22,26H,3-5,8-9,14-17,20H2,1-2H3,(H,34,37);1H4
InChIKeyZNOXBYUXPKAGPS-UHFFFAOYSA-N
XLogP23.58
TPSA358.37 Ų
H-Bond Donors4
H-Bond Acceptors19
Rotatable Bonds18
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002330.96
LogP ≤ 523.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1019

Analyze 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate with MolForge

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Related Compounds

13-cyclohexyl-N-[[3-[6-(4,4-difluoropiperidine-1-carbonyl)-10-[(dimethylsulfamoylamino)-hydroxymethyl]-7H-indolo[2,1-a][2]benzazepin-13-yl]cyclohexyl]methyl-methylsulfamoyl]-6-(4-fluoropiperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide
CID 143427351
[4-[6-[4-(3-fluoropiperidin-1-yl)-3,6-dihydro-2H-pyridine-1-carbonyl]-10-methoxycarbonyl-7H-indolo[2,1-a][2]benzazepin-13-yl]cyclohexyl]methyl 13-cyclohexyl-6-(3-fluoropiperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
CID 143427539
methyl 13-cyclohexyl-6-[(3R,5S)-3-[[4-[6-[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]-10-(dimethylsulfamoylcarbamoyl)-3-fluoro-7H-indolo[2,1-a][2]benzazepin-13-yl]cyclohexyl]methyl]-5-methylpiperazine-1-carbonyl]-3-fluoro-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
CID 143523361
13-cyclohexyl-6-(morpholine-4-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;bis(13-cyclohexyl-6-(morpholine-4-carbonyl)-N-(trifluoromethylsulfonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide);trifluoromethanesulfonamide
CID 157798848
N-(4-acetylphenyl)-2,5-dimethyl-1-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide;1-(1-azabicyclo[2.2.2]octan-3-yl)-2,5-dimethyl-N-[4-methyl-3-(trifluoromethyl)phenyl]pyrrole-3-carboxamide;3-cyclohexyl-1-[2-(dimethylamino)-2-oxoethyl]-2-[1-[2-(dimethylamino)-2-oxoethyl]pyrrol-3-yl]indole-6-carboxylic acid;1-[2-(dimethylamino)ethyl]-N-(2-fluoro-4-methylphenyl)-2,5-dimethylpyrrole-3-carboxamide
CID 158162396
lithium;2-O-tert-butyl 8-O-methyl 1,3,4,5-tetrahydroindeno[1,2-c]pyridine-2,8-dicarboxylate;N-[1-(cyclohexylmethyl)piperidin-4-yl]-5-methyl-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indole-8-carboxamide;methane;methyl 5-methyl-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indole-8-carboxylate;5-methyl-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indole-8-carboxylic acid;hydroxide
CID 158666744
4,6-dimethyl-3-[3-[2-methyl-1-[1-[1-methyl-2-(trifluoromethyl)piperidin-4-yl]ethyl]indol-3-yl]-3-oxopropyl]-1H-pyridin-2-one;methyl 2-methyl-1-[1-[1-methyl-2-(trifluoromethyl)piperidin-4-yl]ethyl]indole-3-carboxylate;methyl 2-methyl-1-[1-[2-(trifluoromethyl)piperidin-4-yl]ethyl]indole-3-carboxylate;2-methyl-1-[1-[1-methyl-2-(trifluoromethyl)piperidin-4-yl]ethyl]indole-3-carboxylic acid
CID 158752117
13-cyclohexyl-6-N-[2-(dimethylamino)ethyl]-10-N-(dimethylsulfamoyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-6,10-dicarboxamide;13-cyclohexyl-6-(3-hydroxypiperidine-1-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;bis(13-cyclohexyl-6-(piperidine-1-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxylic acid)
CID 90794168
13-cyclohexyl-6-(piperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methyl 13-cyclohexyl-6-(piperidine-1-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylate
CID 91597085
(3S)-6-[acetamido(methyl)carbamoyl]-3-[[[6-[acetamido(methyl)carbamoyl]-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carbonyl]sulfamoyl-methylamino]methyl]-13-cyclohexyl-2,3,4,4a,7,13b-hexahydro-1H-indolo[2,1-a][2]benzazepine-10-carboxylic acid
CID 143427451
butyl 4-[3-(3-butoxycarbonylphenyl)piperidine-1-carbonyl]-2-(2,5-dimethylpyrrol-1-yl)benzoate;2-[4-carboxy-3-(2,5-dimethylpyrrol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-6-carboxylic acid;4-[3-(3-carboxyphenyl)piperidine-1-carbonyl]-2-(2,5-dimethylpyrrol-1-yl)benzoic acid;4-[4-(3-carboxyphenyl)piperidine-1-carbonyl]-2-(2,5-dimethylpyrrol-1-yl)benzoic acid;4-[4-(4-carboxyphenyl)piperidine-1-carbonyl]-2-(2,5-dimethylpyrrol-1-yl)benzoic acid
CID 157075609
13-cyclohexyl-N-cyclopropylsulfonyl-6-(morpholine-4-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-N-cyclopropylsulfonyl-6-(morpholine-4-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-(morpholine-4-carbonyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;cyclopropanesulfonamide
CID 157076182

Frequently Asked Questions

What is the IUPAC name of 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate?
The IUPAC name of 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate (CID 162169464) is 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate.
What is the SMILES notation for 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate?
The canonical SMILES for 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate is C.CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3.COC(=O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(NC(C)=O)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(C(=O)N2CCCC2)CC1)=Cc1ccccc1-3.O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCCC2=O)CC1)=Cc1ccccc1-3.
What is the InChIKey of 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate?
The InChIKey is ZNOXBYUXPKAGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H43N5O5S.C35H39N3O4.C34H37N3O4.C33H37N3O4.CH4/c1-38(2)47(45,46)37-35(43)26-14-15-30-31(22-26)41-23-27(36(44)39-19-16-28(17-20-39)40-18-8-13-32(40)42)21-25-11-6-7-12-29(25)34(41)33(30)24-9-4-3-5-10-24;39-33(36-16-6-7-17-36)24-14-18-37(19-15-24)34(40)27-20-25-10-4-5-11-28(25)32-31(23-8-2-1-3-9-23)29-13-12-26(35(41)42)21-30(29)38(32)22-27;38-30-11-6-16-36(30)26-14-17-35(18-15-26)33(39)25-19-23-9-4-5-10-27(23)32-31(22-7-2-1-3-8-22)28-13-12-24(34(40)41)20-29(28)37(32)21-25;1-21(37)34-26-14-16-35(17-15-26)32(38)25-18-23-10-6-7-11-27(23)31-30(22-8-4-3-5-9-22)28-13-12-24(33(39)40-2)19-29(28)36(31)20-25;/h6-7,11-12,14-15,21-22,24,28H,3-5,8-10,13,16-20,23H2,1-2H3,(H,37,43);4-5,10-13,20-21,23-24H,1-3,6-9,14-19,22H2,(H,41,42);4-5,9-10,12-13,19-20,22,26H,1-3,6-8,11,14-18,21H2,(H,40,41);6-7,10-13,18-19,22,26H,3-5,8-9,14-17,20H2,1-2H3,(H,34,37);1H4.
What are the key properties of 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate?
13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate has a molecular weight of 2330.96 g/mol, XLogP of 23.58, 18 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 13-cyclohexyl-N-(dimethylsulfamoyl)-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxamide;13-cyclohexyl-6-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;13-cyclohexyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-carbonyl]-7H-indolo[2,1-a][2]benzazepine-10-carboxylic acid;methane;methyl 6-(4-acetamidopiperidine-1-carbonyl)-13-cyclohexyl-7H-indolo[2,1-a][2]benzazepine-10-carboxylate is sourced from PubChem (CID 162169464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).