Benzamide, N-[4-(1H-benzimidazol-2-yl)phenyl]-
Basic information
- CAS
98806-50-9- Standard SMILES
O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccccc1- InChIKey
FBQLHSPREUMECT-UHFFFAOYSA-N- Molecular formula
- C20H15N3O
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.12151211
Names & identifiers
- Preferred name
- Benzamide, N-[4-(1H-benzimidazol-2-yl)phenyl]-
- IUPAC
- N-[4-(1H-benzimidazol-2-yl)phenyl]benzamide
- English name
- N-(4-(1H-benzo[d]imidazol-2-yl)phenyl)benzamide
- Molecular formula
- C20H15N3O
- Molecular weight
- 313.35
Names & synonyms
98806-50-9Benzamide, N-[4-(1H-benzimidazol-2-yl)phenyl]-N-[4-(1H-benzimidazol-2-yl)phenyl]benzamideN-(4-(1H-benzo[d]imidazol-2-yl)phenyl)benzamideCHEMBL4285334CBMicro_025537ChemDiv2_003959Oprea1_729116SCHEMBL2242293SCHEMBL15157862DTXSID10351454HMS1380D21
Show more names
BDBM50541086CCG-12370STK864734AKOS002180625IDI1_002674N-(4-benzimidazol-2-ylphenyl)benzamideBIM-0025306.P001DB-088914
Database identifiers
- CAS
98806-50-9- PubChem CID
- 700666
- DTXSID
DTXSID10351454- ChEMBL
CHEMBL4285334
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 427
Physicochemical properties
- Melting point
- 335 °C · 335 °C
- Density
- 1.309 · 1.309±0.06 g/cm3(Predicted)
- pka
- 11.49 · 11.49±0.10(Predicted)
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Related reactions
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Compound notes
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