2-{[(6-chloro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
Chemical Structure Depiction of
2-{[(6-chloro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
2-{[(6-chloro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide
Compound characteristics
| Compound ID: | V008-3072 |
| Compound Name: | 2-{[(6-chloro-2H,4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-N,N-diethyl-1-[(oxolan-2-yl)methyl]-1H-benzimidazole-5-sulfonamide |
| Molecular Weight: | 552.11 |
| Molecular Formula: | C25 H30 Cl N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CCN(CC)S(c1ccc2c(c1)nc(n2CC1CCCO1)SCc1cc(cc2COCOc12)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8366 |
| logD: | 4.8363 |
| logSw: | -4.8687 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.117 |
| InChI Key: | RHENDRIHYCITSO-HXUWFJFHSA-N |