3-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
3-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | Y503-3826 |
| Compound Name: | 3-(4-chloro-3-nitro-1H-pyrazol-1-yl)-1-(4-methylpiperidin-1-yl)propan-1-one |
| Molecular Weight: | 300.74 |
| Molecular Formula: | C12 H17 Cl N4 O3 |
| Smiles: | CC1CCN(CC1)C(CCn1cc(c(n1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4793 |
| logD: | 1.4793 |
| logSw: | -2.3833 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.205 |
| InChI Key: | SLAPAYRRNLRAGT-UHFFFAOYSA-N |