Basic information
- Standard SMILES
COC[C@H](NC(=O)c1ccc(N2CCOCCC2=O)c(C)c1)c1nc2cc(Cl)ccc2[nH]1- InChIKey
AZKQDZGIBJQGDH-IBGZPJMESA-N- Molecular formula
- C23H25ClN4O4
- Average molar mass
- 456.9 g/mol
- Monoisotopic mass
- 456.156433
Names & identifiers
- Preferred name
- N-[(1R)-1-(5-chloro-1H-benzimidazol-2-yl)-2-methoxy-ethyl]-3-methyl-4-(5-oxo-[1,4]oxazepan-4-yl)-benzamide
- IUPAC
- N-[(1R)-1-(6-chloro-1H-benzimidazol-2-yl)-2-methoxyethyl]-3-methyl-4-(5-oxo-1,4-oxazepan-4-yl)benzamide
Names & synonyms
SCHEMBL1481583AZKQDZGIBJQGDH-IBGZPJMESA-NN-[(1R)-1-(5-chloro-1H-benzimidazol-2-yl)-2-methoxy-ethyl]-3-methyl-4-(5-oxo-[1,4]oxazepan-4-yl)-benzamide
Database identifiers
- PubChem CID
- 59711677
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 96.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 668
Related reactions
4 records
Compound notes
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