1-benzyl-6-hydroxy-4-[3-(4-methoxyphenyl)-1H-pyrazole-4-carbonyl]-1,4-diazepan-2-one
Chemical Structure Depiction of
1-benzyl-6-hydroxy-4-[3-(4-methoxyphenyl)-1H-pyrazole-4-carbonyl]-1,4-diazepan-2-one
1-benzyl-6-hydroxy-4-[3-(4-methoxyphenyl)-1H-pyrazole-4-carbonyl]-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1227 |
| Compound Name: | 1-benzyl-6-hydroxy-4-[3-(4-methoxyphenyl)-1H-pyrazole-4-carbonyl]-1,4-diazepan-2-one |
| Molecular Weight: | 420.47 |
| Molecular Formula: | C23 H24 N4 O4 |
| Smiles: | COc1ccc(cc1)c1c(c[nH]n1)C(N1CC(CN(Cc2ccccc2)C(C1)=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4006 |
| logD: | 1.4006 |
| logSw: | -2.2243 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.178 |
| InChI Key: | BCXSBMIEZVWCCB-GOSISDBHSA-N |