4-tert-butyl-N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
4-tert-butyl-N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-1057 |
| Compound Name: | 4-tert-butyl-N-{N'-(4-chloro-2-methylphenyl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 494.08 |
| Molecular Formula: | C28 H36 Cl N5 O |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2ccc(cc2)C(C)(C)C)=O)=N/c2ccc(cc2C)[Cl])c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.5771 |
| logD: | 6.457 |
| logSw: | -6.2915 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.273 |
| InChI Key: | VUZZNLRZASUBJK-UHFFFAOYSA-N |