5-(4-fluorophenyl)-7-methyl-4-{4-[(propan-2-yl)oxy]benzoyl}-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
5-(4-fluorophenyl)-7-methyl-4-{4-[(propan-2-yl)oxy]benzoyl}-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
5-(4-fluorophenyl)-7-methyl-4-{4-[(propan-2-yl)oxy]benzoyl}-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0117 |
| Compound Name: | 5-(4-fluorophenyl)-7-methyl-4-{4-[(propan-2-yl)oxy]benzoyl}-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 432.49 |
| Molecular Formula: | C26 H25 F N2 O3 |
| Smiles: | CC(C)Oc1ccc(cc1)C(N1CC(Nc2ccc(C)cc2C1c1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9746 |
| logD: | 4.9746 |
| logSw: | -4.5759 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.829 |
| InChI Key: | RAGOEYNQLPSOPO-VWLOTQADSA-N |