6-hydroxy-4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
6-hydroxy-4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
6-hydroxy-4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-0327 |
| Compound Name: | 6-hydroxy-4-{5-methyl-4-[(4-methyl-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbonyl}-1-(2-phenylethyl)-1,4-diazepan-2-one |
| Molecular Weight: | 437.5 |
| Molecular Formula: | C23 H27 N5 O4 |
| Smiles: | Cc1cnn(Cc2c(C(N3CC(CN(CCc4ccccc4)C(C3)=O)O)=O)noc2C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.875 |
| logD: | 0.8749 |
| logSw: | -1.2783 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.16 |
| InChI Key: | QZGHFKWFWRJHPF-LJQANCHMSA-N |