2-bromo-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxyphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxyphenyl)carbamimidoyl}benzamide
2-bromo-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxyphenyl)carbamimidoyl}benzamide
Compound characteristics
Compound ID: | F341-0566 |
Compound Name: | 2-bromo-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(2-methoxyphenyl)carbamimidoyl}benzamide |
Molecular Weight: | 498.42 |
Molecular Formula: | C24 H28 Br N5 O2 |
Smiles: | CCn1c(C)c(CCN/C(NC(c2ccccc2[Br])=O)=N/c2ccccc2OC)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 3.462 |
logD: | 3.4037 |
logSw: | -3.8971 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 62.903 |
InChI Key: | MRPMZPOXVSWXDK-UHFFFAOYSA-N |