4-[(2,4-dichlorophenoxy)acetyl]-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
4-[(2,4-dichlorophenoxy)acetyl]-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
4-[(2,4-dichlorophenoxy)acetyl]-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0804 |
| Compound Name: | 4-[(2,4-dichlorophenoxy)acetyl]-7-fluoro-5-(4-fluorophenyl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 477.29 |
| Molecular Formula: | C23 H16 Cl2 F2 N2 O3 |
| Smiles: | C1C(Nc2ccc(cc2C(c2ccc(cc2)F)N1C(COc1ccc(cc1[Cl])[Cl])=O)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8141 |
| logD: | 4.8141 |
| logSw: | -5.109 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.084 |
| InChI Key: | YTXKKERCEXLLPS-QHCPKHFHSA-N |