3-methyl-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-methyl-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
3-methyl-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F340-1726 |
| Compound Name: | 3-methyl-N-{N'-[3-(methylsulfanyl)phenyl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C23 H27 N5 O S |
| Smiles: | Cc1cccc(c1)C(NC(/NCc1c(C)nn(C)c1C)=N/c1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5679 |
| logD: | 3.5221 |
| logSw: | -3.9322 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.691 |
| InChI Key: | LGKLSANOSNWFIV-UHFFFAOYSA-N |