Basic information
- Standard SMILES
Cc1nc2c(-c3ccn[nH]3)cc(N3CCOCC3)cc2n1Cc1cccc(Cl)c1Cl- InChIKey
BMTDPIVOOMZUAT-UHFFFAOYSA-N- Molecular formula
- C22H21Cl2N5O
- Average molar mass
- 442.3 g/mol
Names & identifiers
- Preferred name
- 1-[(2,3-dichlorophenyl)methyl]-2-methyl-6-(4-morpholinyl)-4-(1H-pyrazol-5-yl)-1H-benzimidazole
- IUPAC
- 4-[3-[(2,3-dichlorophenyl)methyl]-2-methyl-7-(1H-pyrazol-5-yl)benzimidazol-5-yl]morpholine
Names & synonyms
SCHEMBL1280848BMTDPIVOOMZUAT-UHFFFAOYSA-N1-[(2,3-dichlorophenyl)methyl]-2-methyl-6-(4-morpholinyl)-4-(1H-pyrazol-5-yl)-1H-benzimidazole
Database identifiers
- PubChem CID
- 56959535
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 580
Related reactions
6 records
Compound notes
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