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Basic information
- Standard SMILES
COCC(=O)N1CC(NC(=O)c2cc(C)c(O)c(C)c2)C(=O)N(CC(=O)O)c2ccccc21- InChIKey
LUDNNHNEYOMLRD-UHFFFAOYSA-N- Molecular formula
- C23H25N3O7
- Average molar mass
- 455.5 g/mol
- Monoisotopic mass
- 455.16925015
Names & identifiers
- IUPAC
- 2-[3-[(4-hydroxy-3,5-dimethylbenzoyl)amino]-1-(2-methoxyacetyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid
Database identifiers
- PubChem CID
- 18465682
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 748
Related reactions
1 records
Compound notes
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