3-(dimethylamino)-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-(dimethylamino)-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
3-(dimethylamino)-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1325 |
| Compound Name: | 3-(dimethylamino)-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 450.61 |
| Molecular Formula: | C24 H30 N6 O S |
| Smiles: | Cc1c(CN\C(NC(c2cccc(c2)N(C)C)=O)=N/c2cccc(c2)SC)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5144 |
| logD: | 3.4689 |
| logSw: | -3.9391 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.495 |
| InChI Key: | LMQKPFVRRNHOBV-UHFFFAOYSA-N |