4-fluoro-N-{N'-[3-(methylsulfanyl)phenyl]-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-fluoro-N-{N'-[3-(methylsulfanyl)phenyl]-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
4-fluoro-N-{N'-[3-(methylsulfanyl)phenyl]-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-1920 |
| Compound Name: | 4-fluoro-N-{N'-[3-(methylsulfanyl)phenyl]-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 439.55 |
| Molecular Formula: | C23 H26 F N5 O S |
| Smiles: | Cc1c(CCN\C(NC(c2ccc(cc2)F)=O)=N/c2cccc(c2)SC)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3473 |
| logD: | 3.3349 |
| logSw: | -3.7868 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.532 |
| InChI Key: | HCMMVSBCQFWNIS-UHFFFAOYSA-N |