1-(adamantan-1-yl)-4-nitro-N-[(pyridin-2-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(adamantan-1-yl)-4-nitro-N-[(pyridin-2-yl)methyl]-1H-pyrazole-3-carboxamide
1-(adamantan-1-yl)-4-nitro-N-[(pyridin-2-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | C301-3437 |
| Compound Name: | 1-(adamantan-1-yl)-4-nitro-N-[(pyridin-2-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H23 N5 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)n1cc(c(C(NCc2ccccn2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0515 |
| logD: | 3.0497 |
| logSw: | -3.4006 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.871 |
| InChI Key: | XGSLINSUBSGRFG-UHFFFAOYSA-N |