7-bromo-5-(4-fluorophenyl)-4-(3,4,5-trimethoxybenzoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-5-(4-fluorophenyl)-4-(3,4,5-trimethoxybenzoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-5-(4-fluorophenyl)-4-(3,4,5-trimethoxybenzoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0257 |
| Compound Name: | 7-bromo-5-(4-fluorophenyl)-4-(3,4,5-trimethoxybenzoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 529.36 |
| Molecular Formula: | C25 H22 Br F N2 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CC(Nc2ccc(cc2C1c1ccc(cc1)F)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.407 |
| logD: | 4.407 |
| logSw: | -4.308 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.004 |
| InChI Key: | OQDLRWJBNLUYBJ-QHCPKHFHSA-N |