N-(adamantan-2-yl)-4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(adamantan-2-yl)-4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
N-(adamantan-2-yl)-4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-6707 |
| Compound Name: | N-(adamantan-2-yl)-4-bromo-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 406.24 |
| Molecular Formula: | C16 H19 Br F3 N3 O |
| Smiles: | Cn1c(c(c(C(NC2C3CC4CC(C3)CC2C4)=O)n1)[Br])C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.8215 |
| logD: | 3.8215 |
| logSw: | -4.0554 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.061 |
| InChI Key: | VDPFCXZKCPYMMY-UHFFFAOYSA-N |