3-chloro-N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
3-chloro-N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-2011 |
| Compound Name: | 3-chloro-N-{N'-(3-chloro-4-fluorophenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 462.35 |
| Molecular Formula: | C22 H22 Cl2 F N5 O |
| Smiles: | Cc1c(CCN/C(NC(c2cccc(c2)[Cl])=O)=N/c2ccc(c(c2)[Cl])F)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1476 |
| logD: | 4.0914 |
| logSw: | -4.5437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.532 |
| InChI Key: | DNMTWJWPPIWNSL-UHFFFAOYSA-N |