4-(4-tert-butylbenzoyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
4-(4-tert-butylbenzoyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
4-(4-tert-butylbenzoyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | C076-0083 |
| Compound Name: | 4-(4-tert-butylbenzoyl)-5-(4-fluorophenyl)-7-methyl-1,3,4,5-tetrahydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C27 H27 F N2 O2 |
| Smiles: | Cc1ccc2c(c1)C(c1ccc(cc1)F)N(CC(N2)=O)C(c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1025 |
| logD: | 6.1025 |
| logSw: | -5.4616 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.026 |
| InChI Key: | LXKSAKAMAVRVGT-VWLOTQADSA-N |