N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}adamantane-1-carboxamide
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y500-7711 |
| Compound Name: | N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}adamantane-1-carboxamide |
| Molecular Weight: | 432.39 |
| Molecular Formula: | C23 H27 Cl2 N3 O |
| Smiles: | Cc1c(c(C)n(Cc2c(cccc2[Cl])[Cl])n1)NC(C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4261 |
| logD: | 5.4252 |
| logSw: | -5.876 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.249 |
| InChI Key: | DSURHARUJIVIQE-UHFFFAOYSA-N |