2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazole
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazole
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazole
Compound characteristics
| Compound ID: | V017-9641 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-(morpholine-4-sulfonyl)-1-propyl-1H-benzimidazole |
| Molecular Weight: | 459.63 |
| Molecular Formula: | C23 H29 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCCn1c2ccc(cc2nc1SCc1cc(C)ccc1C)S(N1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5608 |
| logD: | 5.5466 |
| logSw: | -5.3421 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.347 |
| InChI Key: | FLHCQNWHVUNDMS-UHFFFAOYSA-N |