6-hydroxy-4-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
6-hydroxy-4-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
6-hydroxy-4-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-1-(2-phenylethyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-1018 |
| Compound Name: | 6-hydroxy-4-{[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-1-(2-phenylethyl)-1,4-diazepan-2-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Smiles: | COc1ccc(cc1)c1c(CN2CC(CN(CCc3ccccc3)C(C2)=O)O)c[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1183 |
| logD: | 2.0132 |
| logSw: | -2.5695 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.241 |
| InChI Key: | KTVKCRWFZXDINT-OAQYLSRUSA-N |