3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide

C14H8Cl3N3O — CID 84580791

IUPAC3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide
SMILESO=C(Nc1ccc2nc(Cl)[nH]c2c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H8Cl3N3O/c15-9-3-1-7(5-10(9)16)13(21)18-8-2-4-11-12(6-8)20-14(17)19-11/h1-6H,(H,18,21)(H,19,20)
InChIKeyPVCGXJLNZNXUQM-UHFFFAOYSA-N
MW340.60 g/mol
LogP4.78
Rot. Bonds2

About 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide

3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide (PubChem CID 84580791) has the molecular formula C14H8Cl3N3O and a molecular weight of 340.60 g/mol. Its IUPAC name is 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide
PubChem CID84580791
Molecular FormulaC14H8Cl3N3O
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC Name3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide
SMILESO=C(Nc1ccc2nc(Cl)[nH]c2c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H8Cl3N3O/c15-9-3-1-7(5-10(9)16)13(21)18-8-2-4-11-12(6-8)20-14(17)19-11/h1-6H,(H,18,21)(H,19,20)
InChIKeyPVCGXJLNZNXUQM-UHFFFAOYSA-N
XLogP4.78
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-3H-benzimidazol-5-yl)benzamide
CID 84581019
3,4-dichloro-N-[4-[6-[(3,4-dichlorobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]benzamide
CID 10166808
N-(2-chloro-3H-benzimidazol-5-yl)-4-(dimethylamino)benzamide
CID 84582445
N-(2-chloro-3H-benzimidazol-5-yl)-3,4,5-trimethoxybenzamide
CID 84580880
N-(3,4-dichlorophenyl)-2-[(2,6-dichlorophenyl)methyl]-3H-benzimidazole-5-carboxamide
CID 58562173
N-(2-chloro-3H-benzimidazol-5-yl)-2-methylpropanamide
CID 84581968
N-(2-chloro-3H-benzimidazol-5-yl)-2,6-dimethoxybenzamide
CID 84579347
N-(2-chloro-3H-benzimidazol-5-yl)-2-methoxyacetamide
CID 84581757
N-(2-chloro-3H-benzimidazol-5-yl)cyclohexanecarboxamide
CID 84581323
3,4-dichloro-N-(3,4-dimethylphenyl)benzamide
CID 677956
2-chloro-N-(2-chloro-3H-benzimidazol-5-yl)-5-[[(1S,3S)-2,2-dichloro-3-(3,5-dichlorophenyl)cyclopropanecarbonyl]amino]benzamide
CID 122619215
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2,6-dichloroanilino)-3H-benzimidazole-5-carboxamide
CID 87318781

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide?
The IUPAC name of 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide (CID 84580791) is 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide.
What is the SMILES notation for 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide?
The canonical SMILES for 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide is O=C(Nc1ccc2nc(Cl)[nH]c2c1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide?
The InChIKey is PVCGXJLNZNXUQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl3N3O/c15-9-3-1-7(5-10(9)16)13(21)18-8-2-4-11-12(6-8)20-14(17)19-11/h1-6H,(H,18,21)(H,19,20).
What are the key properties of 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide?
3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide has a molecular weight of 340.60 g/mol, XLogP of 4.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-(2-chloro-3H-benzimidazol-5-yl)benzamide is sourced from PubChem (CID 84580791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).