2-({[4-(difluoromethoxy)phenyl]methyl}sulfanyl)-5-(3-methylpiperidine-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Chemical Structure Depiction of
2-({[4-(difluoromethoxy)phenyl]methyl}sulfanyl)-5-(3-methylpiperidine-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
2-({[4-(difluoromethoxy)phenyl]methyl}sulfanyl)-5-(3-methylpiperidine-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | V002-7221 |
| Compound Name: | 2-({[4-(difluoromethoxy)phenyl]methyl}sulfanyl)-5-(3-methylpiperidine-1-sulfonyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole |
| Molecular Weight: | 551.67 |
| Molecular Formula: | C26 H31 F2 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CC1CCCN(C1)S(c1ccc2c(c1)nc(n2CC1CCCO1)SCc1ccc(cc1)OC(F)F)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7228 |
| logD: | 4.7225 |
| logSw: | -4.5088 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.381 |
| InChI Key: | NJAOWADMSOHGNN-UHFFFAOYSA-N |