7-bromo-5-phenyl-4-(4-phenylbutanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-5-phenyl-4-(4-phenylbutanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-5-phenyl-4-(4-phenylbutanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0589 |
| Compound Name: | 7-bromo-5-phenyl-4-(4-phenylbutanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 463.37 |
| Molecular Formula: | C25 H23 Br N2 O2 |
| Smiles: | C(CC(N1CC(Nc2ccc(cc2C1c1ccccc1)[Br])=O)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7643 |
| logD: | 5.7643 |
| logSw: | -5.7937 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.499 |
| InChI Key: | VLUPXSWTUQTBCJ-VWLOTQADSA-N |