1-benzyl-4-(1-ethyl-1H-pyrazole-3-carbonyl)-6-hydroxy-1,4-diazepan-2-one
Chemical Structure Depiction of
1-benzyl-4-(1-ethyl-1H-pyrazole-3-carbonyl)-6-hydroxy-1,4-diazepan-2-one
1-benzyl-4-(1-ethyl-1H-pyrazole-3-carbonyl)-6-hydroxy-1,4-diazepan-2-one
Compound characteristics
Compound ID: | SA85-0492 |
Compound Name: | 1-benzyl-4-(1-ethyl-1H-pyrazole-3-carbonyl)-6-hydroxy-1,4-diazepan-2-one |
Molecular Weight: | 342.4 |
Molecular Formula: | C18 H22 N4 O3 |
Smiles: | CCn1ccc(C(N2CC(CN(Cc3ccccc3)C(C2)=O)O)=O)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 0.1075 |
logD: | 0.1075 |
logSw: | -1.3109 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.829 |
InChI Key: | HUHILJCHFWFWNY-OAHLLOKOSA-N |