4-(3,4-diethoxybenzoyl)-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
4-(3,4-diethoxybenzoyl)-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
4-(3,4-diethoxybenzoyl)-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0401 |
| Compound Name: | 4-(3,4-diethoxybenzoyl)-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 466.48 |
| Molecular Formula: | C26 H24 F2 N2 O4 |
| Smiles: | CCOc1ccc(cc1OCC)C(N1CC(Nc2ccc(cc2C1c1ccc(cc1)F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0424 |
| logD: | 4.0424 |
| logSw: | -4.0768 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.446 |
| InChI Key: | VPEVVVSNYRJFNK-VWLOTQADSA-N |