2,3-bis{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,4-dioxo-1lambda~5~,4lambda~5~-quinoxaline--hydrogen bromide (1/2)
Chemical Structure Depiction of
2,3-bis{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,4-dioxo-1lambda~5~,4lambda~5~-quinoxaline--hydrogen bromide (1/2)
2,3-bis{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,4-dioxo-1lambda~5~,4lambda~5~-quinoxaline--hydrogen bromide (1/2)
Compound characteristics
| Compound ID: | 5055-9164 |
| Compound Name: | 2,3-bis{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1,4-dioxo-1lambda~5~,4lambda~5~-quinoxaline--hydrogen bromide (1/2) |
| Molecular Weight: | 648.4 |
| Molecular Formula: | C24 H18 N6 O2 S2 |
| Salt: | 2HBr |
| Smiles: | C(c1c(CSc2nc3ccccc3[nH]2)[n+](c2ccccc2[n+]1[O-])[O-])Sc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.0698 |
| logD: | 4.0515 |
| logSw: | -4.3607 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.1 |
| InChI Key: | WNGAWHNBVQBICP-UHFFFAOYSA-N |