4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide

C17H13Cl2N3O3S — CID 155116290

IUPAC4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide
SMILESCc1[nH]c(C(=O)NS(=O)(=O)c2ccccc2Cl)nc1-c1ccccc1Cl
InChIInChI=1S/C17H13Cl2N3O3S/c1-10-15(11-6-2-3-7-12(11)18)21-16(20-10)17(23)22-26(24,25)14-9-5-4-8-13(14)19/h2-9H,1H3,(H,20,21)(H,22,23)
InChIKeyADKKQDRIMGWXIY-UHFFFAOYSA-N
MW410.28 g/mol
LogP3.81
Rot. Bonds4

About 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide

4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide (PubChem CID 155116290) has the molecular formula C17H13Cl2N3O3S and a molecular weight of 410.28 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide.

Molecular Properties

Compound Name4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide
PubChem CID155116290
Molecular FormulaC17H13Cl2N3O3S
Molecular Weight410.28 g/mol
Exact Mass409.01
IUPAC Name4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide
SMILESCc1[nH]c(C(=O)NS(=O)(=O)c2ccccc2Cl)nc1-c1ccccc1Cl
InChIInChI=1S/C17H13Cl2N3O3S/c1-10-15(11-6-2-3-7-12(11)18)21-16(20-10)17(23)22-26(24,25)14-9-5-4-8-13(14)19/h2-9H,1H3,(H,20,21)(H,22,23)
InChIKeyADKKQDRIMGWXIY-UHFFFAOYSA-N
XLogP3.81
TPSA91.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.28
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-chlorophenyl)-5-methyl-1H-imidazole-2-carboxylic acid
CID 105498309
5-chloro-2-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-1-methylimidazole-4-carboxamide
CID 155116473
N-(2-chlorophenyl)sulfonyl-1-methyl-2-naphthalen-1-ylimidazole-4-carboxamide
CID 146335135
N-(2-chlorophenyl)sulfonyl-2-(2-ethylsulfonylphenyl)-1-methylimidazole-4-carboxamide
CID 155116421
2-(2-chlorophenyl)-N-(2-iodophenyl)sulfonyl-1-methylimidazole-4-carboxamide
CID 155116564
N-(2-chlorophenyl)sulfonyl-3-methoxybenzamide
CID 139085848
N-(benzenesulfonyl)-2-(2-chlorophenyl)-1-methylimidazole-4-carboxamide
CID 155116240
1-(2-chlorophenyl)sulfonyl-3-(dimethylamino)urea
CID 6610584
2-(2,3-dichlorophenyl)-1-methyl-N-(2-methylphenyl)sulfonylimidazole-4-carboxamide
CID 130437812
2-(2-chlorophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-1-methylimidazole-4-carboxamide
CID 152842079
N-(2-chlorophenyl)sulfonyl-3-[2-(3,5-dimethylphenyl)ethyl]-3H-pyrrole-5-carboxamide
CID 142342379
1-[[4,6-bis(methylsulfanyl)-1,3,5-triazin-2-yl]sulfanyl]-3-(2-chlorophenyl)sulfonylurea
CID 110192008

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide?
The IUPAC name of 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide (CID 155116290) is 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide.
What is the SMILES notation for 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide?
The canonical SMILES for 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide is Cc1[nH]c(C(=O)NS(=O)(=O)c2ccccc2Cl)nc1-c1ccccc1Cl.
What is the InChIKey of 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide?
The InChIKey is ADKKQDRIMGWXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O3S/c1-10-15(11-6-2-3-7-12(11)18)21-16(20-10)17(23)22-26(24,25)14-9-5-4-8-13(14)19/h2-9H,1H3,(H,20,21)(H,22,23).
What are the key properties of 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide?
4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide has a molecular weight of 410.28 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-N-(2-chlorophenyl)sulfonyl-5-methyl-1H-imidazole-2-carboxamide is sourced from PubChem (CID 155116290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).