4-(3,5-dimethylbenzoyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
4-(3,5-dimethylbenzoyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
4-(3,5-dimethylbenzoyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1058 |
| Compound Name: | 4-(3,5-dimethylbenzoyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one |
| Molecular Weight: | 318.41 |
| Molecular Formula: | C18 H26 N2 O3 |
| Smiles: | CC(C)CN1CC(CN(CC1=O)C(c1cc(C)cc(C)c1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7996 |
| logD: | 1.7996 |
| logSw: | -1.6846 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.716 |
| InChI Key: | AVOGQJSYXPDVPP-MRXNPFEDSA-N |