2-{[(4-bromophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(morpholine-4-sulfonyl)-1H-benzimidazole
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(morpholine-4-sulfonyl)-1H-benzimidazole
2-{[(4-bromophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(morpholine-4-sulfonyl)-1H-benzimidazole
Compound characteristics
| Compound ID: | V003-6058 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-1-(3-ethoxypropyl)-5-(morpholine-4-sulfonyl)-1H-benzimidazole |
| Molecular Weight: | 554.52 |
| Molecular Formula: | C23 H28 Br N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CCOCCCn1c2ccc(cc2nc1SCc1ccc(cc1)[Br])S(N1CCOCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.542 |
| logD: | 4.5407 |
| logSw: | -4.3174 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.324 |
| InChI Key: | XRCUTWNZTIMISF-UHFFFAOYSA-N |