N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-2,3-dimethoxybenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-2,3-dimethoxybenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-2,3-dimethoxybenzamide
Compound characteristics
| Compound ID: | F341-0429 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-2,3-dimethoxybenzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C28 H37 N5 O3 |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2cccc(c2OC)OC)=O)=N/c2ccc(cc2)C(C)C)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3966 |
| logD: | 4.105 |
| logSw: | -4.382 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.318 |
| InChI Key: | OYCQDZQIQREKAY-UHFFFAOYSA-N |