5-(3-chloropropanoyl)-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(3-chloropropanoyl)-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(3-chloropropanoyl)-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | 8010-0227 |
| Compound Name: | 5-(3-chloropropanoyl)-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 328.8 |
| Molecular Formula: | C18 H17 Cl N2 O2 |
| Smiles: | C(C[Cl])C(N1C(CC(Nc2ccccc12)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7247 |
| logD: | 2.6783 |
| logSw: | -3.0579 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.603 |
| InChI Key: | VAXKOWJBFYUAFB-INIZCTEOSA-N |