N-[(adamantan-1-yl)methyl]-1-(phenoxymethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-1-(phenoxymethyl)-1H-pyrazole-3-carboxamide
N-[(adamantan-1-yl)methyl]-1-(phenoxymethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-2512 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-1-(phenoxymethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 365.47 |
| Molecular Formula: | C22 H27 N3 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)CNC(c1ccn(COc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7019 |
| logD: | 4.7019 |
| logSw: | -4.6491 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.048 |
| InChI Key: | HUQZJQVUOINVNU-UHFFFAOYSA-N |