N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide
Compound characteristics
Compound ID: | F341-1064 |
Compound Name: | N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3-methylbenzamide |
Molecular Weight: | 452 |
Molecular Formula: | C25 H30 Cl N5 O |
Smiles: | CCn1c(C)c(CCN/C(NC(c2cccc(C)c2)=O)=N/c2ccc(cc2C)[Cl])c(C)n1 |
Stereo: | ACHIRAL |
logP: | 5.1537 |
logD: | 5.0293 |
logSw: | -5.5196 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.273 |
InChI Key: | JFPKUUXYTPTVSE-UHFFFAOYSA-N |