3-(dimethylamino)-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-(dimethylamino)-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
3-(dimethylamino)-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-0080 |
| Compound Name: | 3-(dimethylamino)-N-{N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-N'-[4-(propan-2-yl)phenyl]carbamimidoyl}benzamide |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C27 H36 N6 O |
| Smiles: | CCn1c(C)c(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2ccc(cc2)C(C)C)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7832 |
| logD: | 3.8822 |
| logSw: | -4.4903 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.934 |
| InChI Key: | PUHFMTQAWBJFIS-UHFFFAOYSA-N |