4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-0382 |
| Compound Name: | 4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-(3-methylphenyl)carbamimidoyl}benzamide |
| Molecular Weight: | 459.63 |
| Molecular Formula: | C28 H37 N5 O |
| Smiles: | CCn1c(C)c(CCN\C(NC(c2ccc(cc2)C(C)(C)C)=O)=N/c2cccc(C)c2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7216 |
| logD: | 5.3387 |
| logSw: | -5.3574 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.971 |
| InChI Key: | PGLFLKHGXOGLGG-UHFFFAOYSA-N |