N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-4-methoxybenzamide
N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | F341-0442 |
| Compound Name: | N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}-4-methoxybenzamide |
| Molecular Weight: | 461.61 |
| Molecular Formula: | C27 H35 N5 O2 |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2ccc(cc2)OC)=O)=N/c2ccc(cc2)C(C)C)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5694 |
| logD: | 4.2158 |
| logSw: | -4.2646 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.515 |
| InChI Key: | RXWROQDCVZICBH-UHFFFAOYSA-N |