3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide

C20H18ClN3O3S — CID 55370754

IUPAC3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)nc1
InChIInChI=1S/C20H18ClN3O3S/c1-14-7-10-19(22-12-14)24-20(25)16-8-9-17(21)18(11-16)28(26,27)23-13-15-5-3-2-4-6-15/h2-12,23H,13H2,1H3,(H,22,24,25)
InChIKeyKYKCLTFIOSJJQK-UHFFFAOYSA-N
MW415.90 g/mol
LogP3.77
Rot. Bonds6

About 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide

3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide (PubChem CID 55370754) has the molecular formula C20H18ClN3O3S and a molecular weight of 415.90 g/mol. Its IUPAC name is 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide
PubChem CID55370754
Molecular FormulaC20H18ClN3O3S
Molecular Weight415.90 g/mol
Exact Mass415.08
IUPAC Name3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)nc1
InChIInChI=1S/C20H18ClN3O3S/c1-14-7-10-19(22-12-14)24-20(25)16-8-9-17(21)18(11-16)28(26,27)23-13-15-5-3-2-4-6-15/h2-12,23H,13H2,1H3,(H,22,24,25)
InChIKeyKYKCLTFIOSJJQK-UHFFFAOYSA-N
XLogP3.77
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.90
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(benzylsulfamoyl)-4-chloro-N-pyridin-2-ylbenzamide
CID 60589876
3-(benzylsulfamoyl)-4-chloro-N-methoxybenzamide
CID 52563097
3-(benzylsulfamoyl)-4-chloro-N-(4-methoxyphenyl)benzamide
CID 24536240
N-[2-(benzylamino)-2-oxoethyl]-3-(benzylsulfamoyl)-4-chlorobenzamide
CID 38639374
N-benzyl-5-(2-bromoacetyl)-2-chlorobenzenesulfonamide
CID 21316702
3-(benzylsulfamoyl)-4-chloro-N-(3-phenylprop-2-ynyl)benzamide
CID 24615553
3-[(2-chlorophenyl)sulfonylamino]-N-(5-methyl-2-pyridinyl)propanamide
CID 35026494
3-(benzylsulfamoyl)-4-chloro-N-(3-ethoxypropyl)benzamide
CID 24540711
4-chloro-3-(pyridin-3-ylmethylsulfamoyl)benzoic acid
CID 2411456
4-chloro-N-[(4-methylphenyl)methyl]-3-(phenylsulfamoyl)benzamide
CID 126414386
3-(benzylsulfamoyl)-N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 35623422
N-benzyl-2-chloro-5-[[[2-(4-methoxyphenyl)acetyl]amino]carbamoyl]benzenesulfonamide
CID 24553911

Frequently Asked Questions

What is the IUPAC name of 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide (CID 55370754) is 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide is Cc1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)NCc3ccccc3)c2)nc1.
What is the InChIKey of 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is KYKCLTFIOSJJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O3S/c1-14-7-10-19(22-12-14)24-20(25)16-8-9-17(21)18(11-16)28(26,27)23-13-15-5-3-2-4-6-15/h2-12,23H,13H2,1H3,(H,22,24,25).
What are the key properties of 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide?
3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 415.90 g/mol, XLogP of 3.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzylsulfamoyl)-4-chloro-N-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 55370754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).