7-bromo-5-phenyl-4-(3-phenylpropanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-bromo-5-phenyl-4-(3-phenylpropanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
7-bromo-5-phenyl-4-(3-phenylpropanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0595 |
| Compound Name: | 7-bromo-5-phenyl-4-(3-phenylpropanoyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 449.35 |
| Molecular Formula: | C24 H21 Br N2 O2 |
| Smiles: | C(Cc1ccccc1)C(N1CC(Nc2ccc(cc2C1c1ccccc1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1833 |
| logD: | 5.1833 |
| logSw: | -5.3747 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.499 |
| InChI Key: | XOODYLMGSGNFEE-DEOSSOPVSA-N |