N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}adamantane-1-carboxamide
Chemical Structure Depiction of
N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}adamantane-1-carboxamide
N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}adamantane-1-carboxamide
Compound characteristics
| Compound ID: | D491-9678 |
| Compound Name: | N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}adamantane-1-carboxamide |
| Molecular Weight: | 349.47 |
| Molecular Formula: | C22 H27 N3 O |
| Smiles: | [H]N(C(C12CC3CC(CC(C3)C2)C1)=O)c1ccnn1Cc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1164 |
| logD: | 5.1163 |
| logSw: | -4.9633 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.796 |
| InChI Key: | OULQZTDRGFOOKJ-UHFFFAOYSA-N |