N-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propyl]adamantane-1-carboxamide
Chemical Structure Depiction of
N-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propyl]adamantane-1-carboxamide
N-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y500-2565 |
| Compound Name: | N-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propyl]adamantane-1-carboxamide |
| Molecular Weight: | 394.35 |
| Molecular Formula: | C19 H28 Br N3 O |
| Smiles: | Cc1c(c(C)n(CCCNC(C23CC4CC(CC(C4)C3)C2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.827 |
| logD: | 3.827 |
| logSw: | -3.9595 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.058 |
| InChI Key: | KALTZZMECQTLER-UHFFFAOYSA-N |