N-butyl-1-cyclopentyl-2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N-methyl-1H-benzimidazole-5-sulfonamide
Chemical Structure Depiction of
N-butyl-1-cyclopentyl-2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N-methyl-1H-benzimidazole-5-sulfonamide
N-butyl-1-cyclopentyl-2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N-methyl-1H-benzimidazole-5-sulfonamide
Compound characteristics
| Compound ID: | V003-4002 |
| Compound Name: | N-butyl-1-cyclopentyl-2-{[(4-ethoxyphenyl)methyl]sulfanyl}-N-methyl-1H-benzimidazole-5-sulfonamide |
| Molecular Weight: | 501.71 |
| Molecular Formula: | C26 H35 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCCCN(C)S(c1ccc2c(c1)nc(n2C1CCCC1)SCc1ccc(cc1)OCC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2201 |
| logD: | 6.22 |
| logSw: | -5.4458 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.357 |
| InChI Key: | YOCWVVIKPUPMLI-UHFFFAOYSA-N |