N-(adamantan-1-yl)-4-bromo-N,1,3-trimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-bromo-N,1,3-trimethyl-1H-pyrazole-5-carboxamide
N-(adamantan-1-yl)-4-bromo-N,1,3-trimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-1853 |
| Compound Name: | N-(adamantan-1-yl)-4-bromo-N,1,3-trimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 366.3 |
| Molecular Formula: | C17 H24 Br N3 O |
| Smiles: | Cc1c(c(C(N(C)C23CC4CC(CC(C4)C3)C2)=O)n(C)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.2719 |
| logD: | 3.2719 |
| logSw: | -3.1606 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.168 |
| InChI Key: | IYQKBMRRCCEBON-UHFFFAOYSA-N |