3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide

C16H15ClN4O2S — CID 131973043

IUPAC3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cncn2-c2ncc(C)cc2Cl)c1
InChIInChI=1S/C16H15ClN4O2S/c1-11-4-3-5-13(6-11)20-24(22,23)15-9-18-10-21(15)16-14(17)7-12(2)8-19-16/h3-10,20H,1-2H3
InChIKeyILHOLVSMTQYZGP-UHFFFAOYSA-N
MW362.84 g/mol
LogP3.34
Rot. Bonds4

About 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide

3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide (PubChem CID 131973043) has the molecular formula C16H15ClN4O2S and a molecular weight of 362.84 g/mol. Its IUPAC name is 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide
PubChem CID131973043
Molecular FormulaC16H15ClN4O2S
Molecular Weight362.84 g/mol
Exact Mass362.06
IUPAC Name3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cncn2-c2ncc(C)cc2Cl)c1
InChIInChI=1S/C16H15ClN4O2S/c1-11-4-3-5-13(6-11)20-24(22,23)15-9-18-10-21(15)16-14(17)7-12(2)8-19-16/h3-10,20H,1-2H3
InChIKeyILHOLVSMTQYZGP-UHFFFAOYSA-N
XLogP3.34
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.84
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-chloro-5-methyl-2-pyridinyl)-N-(3,5-dimethylphenyl)imidazole-4-sulfonamide
CID 131973042
1-(3-chloro-5-methyl-2-pyridinyl)-N-(4-chlorophenyl)pyrrole-2-sulfonamide
CID 157375331
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-[3-(2-cyclobutylethyl)phenyl]imidazole-4-sulfonamide
CID 162601293
2,3,4,5,6-pentafluoro-N-(3-methylphenyl)benzenesulfonamide
CID 20703904
2-chloro-N-(3-methylphenyl)pyridine-4-sulfonamide
CID 54895572
2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 63000163
N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 3658049
3-(3,4-dichlorophenyl)sulfonyl-N-(3-methylphenyl)benzenesulfonamide
CID 1101032
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(3-methoxy-5-methylphenyl)pyrrole-2-sulfonamide
CID 70138416
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluoro-3-methylphenyl)pyrrole-2-sulfonamide
CID 70138441
4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688094

Frequently Asked Questions

What is the IUPAC name of 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide?
The IUPAC name of 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide (CID 131973043) is 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide.
What is the SMILES notation for 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide?
The canonical SMILES for 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide is Cc1cccc(NS(=O)(=O)c2cncn2-c2ncc(C)cc2Cl)c1.
What is the InChIKey of 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide?
The InChIKey is ILHOLVSMTQYZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN4O2S/c1-11-4-3-5-13(6-11)20-24(22,23)15-9-18-10-21(15)16-14(17)7-12(2)8-19-16/h3-10,20H,1-2H3.
What are the key properties of 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide?
3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide has a molecular weight of 362.84 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chloro-5-methyl-2-pyridinyl)-N-(3-methylphenyl)imidazole-4-sulfonamide is sourced from PubChem (CID 131973043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).