7-bromo-4-(2,3-dimethoxybenzoyl)-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-4-(2,3-dimethoxybenzoyl)-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-4-(2,3-dimethoxybenzoyl)-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0227 |
| Compound Name: | 7-bromo-4-(2,3-dimethoxybenzoyl)-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 499.34 |
| Molecular Formula: | C24 H20 Br F N2 O4 |
| Smiles: | COc1cccc(C(N2CC(Nc3ccc(cc3C2c2ccc(cc2)F)[Br])=O)=O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5929 |
| logD: | 4.5929 |
| logSw: | -4.44 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.373 |
| InChI Key: | BTUVZDYKCHSUPA-QFIPXVFZSA-N |