N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxy-5-methylphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxy-5-methylphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxy-5-methylphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | F341-0965 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxy-5-methylphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C26 H32 F N5 O2 |
| Smiles: | CCn1c(C)c(CCN\C(NC(c2ccc(C)c(c2)F)=O)=N/c2cc(C)ccc2OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2653 |
| logD: | 4.0161 |
| logSw: | -4.3064 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.903 |
| InChI Key: | KKEJEQICCOEDIK-UHFFFAOYSA-N |