6-hydroxy-4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,2-oxazole-3-carbonyl}-1-(2-methylpropyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
6-hydroxy-4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,2-oxazole-3-carbonyl}-1-(2-methylpropyl)-1,4-diazepan-2-one
6-hydroxy-4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,2-oxazole-3-carbonyl}-1-(2-methylpropyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1121 |
| Compound Name: | 6-hydroxy-4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,2-oxazole-3-carbonyl}-1-(2-methylpropyl)-1,4-diazepan-2-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C22 H29 N3 O5 |
| Smiles: | CC(C)CN1CC(CN(CC1=O)C(c1c(COc2ccc(C)cc2)c(C)on1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1652 |
| logD: | 2.1652 |
| logSw: | -2.4795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.175 |
| InChI Key: | GQMVNTPFLGHANY-QGZVFWFLSA-N |