2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazole
Chemical Structure Depiction of
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazole
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazole
Compound characteristics
| Compound ID: | V012-2557 |
| Compound Name: | 2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-[3-(morpholin-4-yl)propyl]-1H-benzimidazole |
| Molecular Weight: | 544.74 |
| Molecular Formula: | C27 H36 N4 O4 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CSc2nc3cc(ccc3n2CCCN2CCOCC2)S(N2CCOCC2)(=O)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 4.2449 |
| logD: | 4.0999 |
| logSw: | -4.104 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 61.966 |
| InChI Key: | URFAKOJIKMSWNU-UHFFFAOYSA-N |