3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
Compound characteristics
Compound ID: | F341-0009 |
Compound Name: | 3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide |
Molecular Weight: | 423.94 |
Molecular Formula: | C23 H26 Cl N5 O |
Smiles: | CCn1c(C)c(CCN/C(NC(c2cccc(c2)[Cl])=O)=N/c2ccccc2)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 3.79 |
logD: | 3.5925 |
logSw: | -4.2976 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.971 |
InChI Key: | KUIIXOBBISOQKQ-UHFFFAOYSA-N |