2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-{4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-{4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide--hydrogen chloride (1/1)
2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-{4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5236-0024 |
| Compound Name: | 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-{4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 521.02 |
| Molecular Formula: | C21 H20 N6 O4 S2 |
| Salt: | HCl |
| Smiles: | Cc1ccnc(NS(c2ccc(cc2)NC(CSc2nc3ccc(cc3[nH]2)OC)=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3162 |
| logD: | 1.7044 |
| logSw: | -3.0399 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.267 |
| InChI Key: | IXMIBHGLVNZRKO-UHFFFAOYSA-N |