1-methyl-2-({N-methyl[3-(methylsulfanyl)phenyl]carbamamido}methyl)-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
Chemical Structure Depiction of
1-methyl-2-({N-methyl[3-(methylsulfanyl)phenyl]carbamamido}methyl)-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
1-methyl-2-({N-methyl[3-(methylsulfanyl)phenyl]carbamamido}methyl)-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide
Compound characteristics
| Compound ID: | L279-0768 |
| Compound Name: | 1-methyl-2-({N-methyl[3-(methylsulfanyl)phenyl]carbamamido}methyl)-N-(propan-2-yl)-1H-benzimidazole-5-carboxamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C22 H27 N5 O2 S |
| Smiles: | CC(C)NC(c1ccc2c(c1)nc(CN(C)C(Nc1cccc(c1)SC)=O)n2C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9271 |
| logD: | 2.9271 |
| logSw: | -3.5491 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.855 |
| InChI Key: | MIYHWNHNXYDVQU-UHFFFAOYSA-N |