N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}-4-(trifluoromethyl)benzamide
N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | F340-0226 |
| Compound Name: | N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-(2-ethylphenyl)carbamimidoyl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C25 H28 F3 N5 O |
| Smiles: | CCc1ccccc1/N=C(\NCc1c(C)nn(CC)c1C)NC(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8199 |
| logD: | 4.268 |
| logSw: | -4.5412 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.432 |
| InChI Key: | YDBZHYGBHBFHOA-UHFFFAOYSA-N |