N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-fluorophenyl)carbamimidoyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-fluorophenyl)carbamimidoyl}-3,5-dimethylbenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-fluorophenyl)carbamimidoyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | F341-0720 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-fluorophenyl)carbamimidoyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C25 H30 F N5 O |
| Smiles: | CCn1c(C)c(CCN\C(NC(c2cc(C)cc(C)c2)=O)=N/c2ccccc2F)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1422 |
| logD: | 3.898 |
| logSw: | -4.2044 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.273 |
| InChI Key: | JBMCJJCEADVHJC-UHFFFAOYSA-N |