3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-0585 |
| Compound Name: | 3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-ethylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 452 |
| Molecular Formula: | C25 H30 Cl N5 O |
| Smiles: | CCc1ccccc1/N=C(/NCCc1c(C)nn(CC)c1C)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7314 |
| logD: | 4.5507 |
| logSw: | -4.7251 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.273 |
| InChI Key: | OICBGRGQNAJLLG-UHFFFAOYSA-N |