4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-6-hydroxy-1-(2-phenylethyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-6-hydroxy-1-(2-phenylethyl)-1,4-diazepan-2-one
4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-6-hydroxy-1-(2-phenylethyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-0339 |
| Compound Name: | 4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-6-hydroxy-1-(2-phenylethyl)-1,4-diazepan-2-one |
| Molecular Weight: | 384.48 |
| Molecular Formula: | C21 H28 N4 O3 |
| Smiles: | Cc1cc(C)n(CCC(N2CC(CN(CCc3ccccc3)C(C2)=O)O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.081 |
| logD: | 0.0807 |
| logSw: | -1.5535 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.881 |
| InChI Key: | DFQDNKNPQYBHIV-LJQANCHMSA-N |