N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | F341-0198 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl}-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C25 H30 F N5 O2 |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2ccc(C)c(c2)F)=O)=N/c2cccc(c2)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2621 |
| logD: | 4.1212 |
| logSw: | -4.3443 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.515 |
| InChI Key: | NWFHIYMKQNFNEF-UHFFFAOYSA-N |