N-(adamantan-1-yl)-4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxamide
N-(adamantan-1-yl)-4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-1318 |
| Compound Name: | N-(adamantan-1-yl)-4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 307.82 |
| Molecular Formula: | C16 H22 Cl N3 O |
| Smiles: | Cc1c(c(C(NC23CC4CC(CC(C4)C3)C2)=O)nn1C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0664 |
| logD: | 3.0664 |
| logSw: | -3.8149 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.38 |
| InChI Key: | CLBCLJGGIYMFKB-UHFFFAOYSA-N |