2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide

C20H22Cl2N2O3S — CID 26906917

IUPAC2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C20H22Cl2N2O3S/c1-24(15-6-3-2-4-7-15)28(26,27)16-12-10-14(11-13-16)23-20(25)17-8-5-9-18(21)19(17)22/h5,8-13,15H,2-4,6-7H2,1H3,(H,23,25)
InChIKeyLMBNEDSJXUIVQV-UHFFFAOYSA-N
MW441.38 g/mol
LogP5.20
Rot. Bonds5

About 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide

2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide (PubChem CID 26906917) has the molecular formula C20H22Cl2N2O3S and a molecular weight of 441.38 g/mol. Its IUPAC name is 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide
PubChem CID26906917
Molecular FormulaC20H22Cl2N2O3S
Molecular Weight441.38 g/mol
Exact Mass440.07
IUPAC Name2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C20H22Cl2N2O3S/c1-24(15-6-3-2-4-7-15)28(26,27)16-12-10-14(11-13-16)23-20(25)17-8-5-9-18(21)19(17)22/h5,8-13,15H,2-4,6-7H2,1H3,(H,23,25)
InChIKeyLMBNEDSJXUIVQV-UHFFFAOYSA-N
XLogP5.20
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.38
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-2,3-dimethylbenzamide
CID 52894118
2,4-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-5-fluorobenzamide
CID 16563331
2-chloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-4-fluorobenzamide
CID 31288662
3-chloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-1-benzothiophene-2-carboxamide
CID 1263674
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]cyclopropanecarboxamide
CID 4924186
[4-[cyclohexyl(methyl)sulfamoyl]phenyl]urea
CID 135231517
N-(4-chlorophenyl)-3-[cyclohexyl(methyl)sulfamoyl]benzamide
CID 2666126
3-(2-chlorophenyl)-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]propanamide
CID 17178988
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 7656046
2-(2-chlorophenoxy)-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]acetamide
CID 4924223
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-2,2-diphenylacetamide
CID 4777920
4-[cyclopentyl(methyl)sulfamoyl]-N-(4-fluorophenyl)benzamide
CID 7656086

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide (CID 26906917) is 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide is CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1.
What is the InChIKey of 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide?
The InChIKey is LMBNEDSJXUIVQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N2O3S/c1-24(15-6-3-2-4-7-15)28(26,27)16-12-10-14(11-13-16)23-20(25)17-8-5-9-18(21)19(17)22/h5,8-13,15H,2-4,6-7H2,1H3,(H,23,25).
What are the key properties of 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide?
2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide has a molecular weight of 441.38 g/mol, XLogP of 5.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 26906917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).