4-[(4-chlorophenoxy)acetyl]-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
4-[(4-chlorophenoxy)acetyl]-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
4-[(4-chlorophenoxy)acetyl]-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0057 |
| Compound Name: | 4-[(4-chlorophenoxy)acetyl]-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 438.88 |
| Molecular Formula: | C24 H20 Cl F N2 O3 |
| Smiles: | Cc1ccc2c(c1)C(c1ccc(cc1)F)N(CC(N2)=O)C(COc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6984 |
| logD: | 4.6984 |
| logSw: | -4.9559 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.998 |
| InChI Key: | YTFBVVXGKUTEBD-DEOSSOPVSA-N |