6-hydroxy-4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]-1-(2-methylpropyl)-1,4-diazepan-2-one
Chemical Structure Depiction of
6-hydroxy-4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]-1-(2-methylpropyl)-1,4-diazepan-2-one
6-hydroxy-4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]-1-(2-methylpropyl)-1,4-diazepan-2-one
Compound characteristics
| Compound ID: | SA85-0290 |
| Compound Name: | 6-hydroxy-4-[3-(3-methoxyphenyl)-1H-pyrazole-5-carbonyl]-1-(2-methylpropyl)-1,4-diazepan-2-one |
| Molecular Weight: | 386.45 |
| Molecular Formula: | C20 H26 N4 O4 |
| Smiles: | CC(C)CN1CC(CN(CC1=O)C(c1cc(c2cccc(c2)OC)n[nH]1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9282 |
| logD: | 1.9278 |
| logSw: | -2.6786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.749 |
| InChI Key: | RFQBXUYXUAGZED-OAHLLOKOSA-N |