{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}(morpholin-4-yl)methanone
Chemical Structure Depiction of
{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}(morpholin-4-yl)methanone
{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}(morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | Y500-0213 |
| Compound Name: | {4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}(morpholin-4-yl)methanone |
| Molecular Weight: | 344.37 |
| Molecular Formula: | C17 H20 N4 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)C(N2CCOCC2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.8315 |
| logD: | 0.8315 |
| logSw: | -1.6766 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.857 |
| InChI Key: | ALZYTORTAHHKNL-UHFFFAOYSA-N |