8-{[(4-chlorophenyl)methyl]sulfanyl}-5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
8-{[(4-chlorophenyl)methyl]sulfanyl}-5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
8-{[(4-chlorophenyl)methyl]sulfanyl}-5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
| Compound ID: | E514-0886 |
| Compound Name: | 8-{[(4-chlorophenyl)methyl]sulfanyl}-5-ethyl-2-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
| Molecular Weight: | 357.86 |
| Molecular Formula: | C18 H16 Cl N3 O S |
| Smiles: | CCc1nnc(c2cc3c(cc(C)o3)n12)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5811 |
| logD: | 4.5806 |
| logSw: | -4.703 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.2812 |
| InChI Key: | XBYGPBWVWMLGLE-UHFFFAOYSA-N |