N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N,3,5-trimethyladamantane-1-carboxamide
Chemical Structure Depiction of
N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N,3,5-trimethyladamantane-1-carboxamide
N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N,3,5-trimethyladamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y502-4518 |
| Compound Name: | N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-N,3,5-trimethyladamantane-1-carboxamide |
| Molecular Weight: | 363.93 |
| Molecular Formula: | C20 H30 Cl N3 O |
| Smiles: | CCn1c(CN(C)C(C23CC4CC(C)(CC(C)(C4)C3)C2)=O)c(cn1)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0275 |
| logD: | 4.0275 |
| logSw: | -4.2154 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.8576 |
| InChI Key: | XVCZIGAFNAANBD-UHFFFAOYSA-N |