Basic information
- Standard SMILES
Cc1cccc(NC(=O)NC2N=C(c3ccccc3F)c3ccccc3N(Cc3ccc4oc(=O)ccc4c3)C2=O)c1- InChIKey
QGLPWERYYGWKBM-UHFFFAOYSA-N- Molecular formula
- C33H25FN4O4
- Average molar mass
- 560.6 g/mol
Names & identifiers
- Preferred name
- N-[(3RS)-2,3-dihydro-5-(2-fluorophenyl)-1-(2-oxo-2H-1-benzopyran-6-yl)methyl-2-oxo-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)urea
- IUPAC
- 1-[5-(2-fluorophenyl)-2-oxo-1-[(2-oxochromen-6-yl)methyl]-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea
Names & synonyms
SCHEMBL8533535QGLPWERYYGWKBM-UHFFFAOYSA-NL014761N-[(3RS)-2,3-dihydro-5-(2-fluorophenyl)-1-(2-oxo-2H-1-benzopyran-6-yl)methyl-2-oxo-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)urea
Database identifiers
- PubChem CID
- 19081331
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,080
Related reactions
2 records
Compound notes
Loading…