4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-(morpholin-4-yl)butan-1-one
Chemical Structure Depiction of
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-(morpholin-4-yl)butan-1-one
4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-(morpholin-4-yl)butan-1-one
Compound characteristics
| Compound ID: | 8018-7915 |
| Compound Name: | 4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-(morpholin-4-yl)butan-1-one |
| Molecular Weight: | 296.32 |
| Molecular Formula: | C13 H20 N4 O4 |
| Smiles: | Cc1c(c(C)n(CCCC(N2CCOCC2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.3225 |
| logD: | -0.3225 |
| logSw: | -0.0959 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.579 |
| InChI Key: | UJYIEZHZDWDKRX-UHFFFAOYSA-N |