N,N-diethyl-2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
N,N-diethyl-2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
Compound characteristics
| Compound ID: | V011-7978 |
| Compound Name: | N,N-diethyl-2-({[4-(methylsulfanyl)phenyl]methyl}sulfanyl)-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide |
| Molecular Weight: | 505.72 |
| Molecular Formula: | C24 H31 N3 O3 S3 |
| Salt: | not_available |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nc(n2CC1CCCO1)SCc1ccc(cc1)SC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8785 |
| logD: | 4.8782 |
| logSw: | -4.6909 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 50.228 |
| InChI Key: | SMFIJIMNIIYDKX-LJQANCHMSA-N |