N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide

C16H10Cl3N3O3S — CID 139453065

IUPACN-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1Cl)c1cn(-c2c(Cl)cccc2Cl)cn1
InChIInChI=1S/C16H10Cl3N3O3S/c17-10-4-1-2-7-14(10)26(24,25)21-16(23)13-8-22(9-20-13)15-11(18)5-3-6-12(15)19/h1-9H,(H,21,23)
InChIKeyMRFDGDWEYRVBTM-UHFFFAOYSA-N
MW430.70 g/mol
LogP3.95
Rot. Bonds4

About N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide

N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide (PubChem CID 139453065) has the molecular formula C16H10Cl3N3O3S and a molecular weight of 430.70 g/mol. Its IUPAC name is N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide
PubChem CID139453065
Molecular FormulaC16H10Cl3N3O3S
Molecular Weight430.70 g/mol
Exact Mass428.95
IUPAC NameN-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1Cl)c1cn(-c2c(Cl)cccc2Cl)cn1
InChIInChI=1S/C16H10Cl3N3O3S/c17-10-4-1-2-7-14(10)26(24,25)21-16(23)13-8-22(9-20-13)15-11(18)5-3-6-12(15)19/h1-9H,(H,21,23)
InChIKeyMRFDGDWEYRVBTM-UHFFFAOYSA-N
XLogP3.95
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.70
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,6-dichlorophenyl)-N-(2,6-dichlorophenyl)sulfonylimidazole-4-carboxamide
CID 139453158
1-(4-bromo-3,5-dichlorophenyl)-N-(2-chlorophenyl)sulfonylimidazole-4-carboxamide
CID 139453276
N-(2-chlorophenyl)sulfonyl-1-[3-chloro-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide
CID 139452977
N-(2-chlorophenyl)sulfonyl-1-[3-fluoro-5-(trifluoromethyl)phenyl]imidazole-4-carboxamide
CID 139453068
N-(2-chlorophenyl)sulfonyl-1-[(2,6-difluorophenyl)methyl]imidazole-4-carboxamide
CID 139452892
N-(2,5-dichlorophenyl)sulfonyl-1-(2-fluorophenyl)imidazole-4-carboxamide
CID 139453060
1-(2,6-dichlorophenyl)imidazole-4-carboxylic acid
CID 151593948
N-(benzenesulfonyl)-1-(3,4,5-trichlorophenyl)imidazole-4-carboxamide
CID 139453257
N-(benzenesulfonyl)-1-(3-chlorophenyl)imidazole-4-carboxamide
CID 139453099
1-(2,3-dichlorophenyl)-N-(2,6-difluorophenyl)sulfonylimidazole-4-carboxamide
CID 139452945
N-(benzenesulfonyl)-1-(3,5-dichlorophenyl)imidazole-4-carboxamide
CID 139453021
N-(2-chloro-5-methoxyphenyl)sulfonyl-1-(2-fluorophenyl)imidazole-4-carboxamide
CID 139453144

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide?
The IUPAC name of N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide (CID 139453065) is N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide is O=C(NS(=O)(=O)c1ccccc1Cl)c1cn(-c2c(Cl)cccc2Cl)cn1.
What is the InChIKey of N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide?
The InChIKey is MRFDGDWEYRVBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl3N3O3S/c17-10-4-1-2-7-14(10)26(24,25)21-16(23)13-8-22(9-20-13)15-11(18)5-3-6-12(15)19/h1-9H,(H,21,23).
What are the key properties of N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide?
N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide has a molecular weight of 430.70 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)sulfonyl-1-(2,6-dichlorophenyl)imidazole-4-carboxamide is sourced from PubChem (CID 139453065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).