N-{N'-(2,4-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{N'-(2,4-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
N-{N'-(2,4-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | F340-1856 |
| Compound Name: | N-{N'-(2,4-dimethylphenyl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C27 H35 N5 O3 |
| Smiles: | CCOc1ccc(cc1OCC)C(NC(/NCc1c(C)nn(C)c1C)=N/c1ccc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8599 |
| logD: | 2.7657 |
| logSw: | -4.083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.413 |
| InChI Key: | KHDPCBNGFXOERT-UHFFFAOYSA-N |