4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-0006 |
| Compound Name: | 4-tert-butyl-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-phenylcarbamimidoyl}benzamide |
| Molecular Weight: | 445.61 |
| Molecular Formula: | C27 H35 N5 O |
| Smiles: | CCn1c(C)c(CCN\C(NC(c2ccc(cc2)C(C)(C)C)=O)=N/c2ccccc2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9217 |
| logD: | 4.728 |
| logSw: | -4.5093 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.971 |
| InChI Key: | ZIRVADNXAHSVHB-UHFFFAOYSA-N |