N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,4-diethoxybenzamide
N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | F341-1948 |
| Compound Name: | N-{N'-(3,5-dimethylphenyl)-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]carbamimidoyl}-3,4-diethoxybenzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C28 H37 N5 O3 |
| Smiles: | CCOc1ccc(cc1OCC)C(NC(\NCCc1c(C)nn(C)c1C)=N/c1cc(C)cc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8782 |
| logD: | 3.2175 |
| logSw: | -4.0788 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.953 |
| InChI Key: | QAMNBXJUPUQHIL-UHFFFAOYSA-N |