N-(adamantan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(adamantan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide
N-(adamantan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-5309 |
| Compound Name: | N-(adamantan-2-yl)-3-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 290.32 |
| Molecular Formula: | C14 H18 N4 O3 |
| Smiles: | C1C2CC3CC1CC(C2)C3NC(c1cc(n[nH]1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6282 |
| logD: | 2.2942 |
| logSw: | -2.9261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.605 |
| InChI Key: | AAVVQHPBYABXOX-UHFFFAOYSA-N |