N-[4-(adamantan-1-yl)phenyl]-1-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanimine
Chemical Structure Depiction of
N-[4-(adamantan-1-yl)phenyl]-1-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanimine
N-[4-(adamantan-1-yl)phenyl]-1-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanimine
Compound characteristics
| Compound ID: | K038-0015 |
| Compound Name: | N-[4-(adamantan-1-yl)phenyl]-1-[5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methanimine |
| Molecular Weight: | 421.89 |
| Molecular Formula: | C22 H23 Cl F3 N3 |
| Smiles: | Cn1c(c(/C=N/c2ccc(cc2)C23CC4CC(CC(C4)C3)C2)c(C(F)(F)F)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1473 |
| logD: | 6.1427 |
| logSw: | -6.5281 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 23.5422 |
| InChI Key: | AUWWQOIHZVXJBJ-UHFFFAOYSA-N |