2-{[(2-chloro-3,6-difluorophenyl)methyl]sulfanyl}-1-(cyclopropylmethyl)-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(2-chloro-3,6-difluorophenyl)methyl]sulfanyl}-1-(cyclopropylmethyl)-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
2-{[(2-chloro-3,6-difluorophenyl)methyl]sulfanyl}-1-(cyclopropylmethyl)-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V005-2628 |
| Compound Name: | 2-{[(2-chloro-3,6-difluorophenyl)methyl]sulfanyl}-1-(cyclopropylmethyl)-5-(pyrrolidine-1-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 498.01 |
| Molecular Formula: | C22 H22 Cl F2 N3 O2 S2 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)nc(n2CC1CC1)SCc1c(ccc(c1[Cl])F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1168 |
| logD: | 6.1167 |
| logSw: | -6.5089 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.077 |
| InChI Key: | BJFIPNJMLCPJMZ-UHFFFAOYSA-N |