3,4-diethoxy-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3,4-diethoxy-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
3,4-diethoxy-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1860 |
| Compound Name: | 3,4-diethoxy-N-{N'-[4-(propan-2-yl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C28 H37 N5 O3 |
| Smiles: | CCOc1ccc(cc1OCC)C(NC(/NCc1c(C)nn(C)c1C)=N/c1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0423 |
| logD: | 3.1414 |
| logSw: | -4.0633 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.111 |
| InChI Key: | NKLAETKNCLVXGS-UHFFFAOYSA-N |