4-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
4-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
4-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1118 |
| Compound Name: | 4-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)-6-hydroxy-1-(2-methylpropyl)-1,4-diazepan-2-one |
| Molecular Weight: | 322.41 |
| Molecular Formula: | C16 H26 N4 O3 |
| Smiles: | CCn1cc(C(N2CC(CN(CC(C)C)C(C2)=O)O)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0353 |
| logD: | -0.0353 |
| logSw: | -1.0819 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.571 |
| InChI Key: | NVWANZXLZAGAFY-CYBMUJFWSA-N |