5-ethyl-8-{[(4-methoxyphenyl)methyl]sulfanyl}-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
5-ethyl-8-{[(4-methoxyphenyl)methyl]sulfanyl}-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
5-ethyl-8-{[(4-methoxyphenyl)methyl]sulfanyl}-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
| Compound ID: | E513-1152 |
| Compound Name: | 5-ethyl-8-{[(4-methoxyphenyl)methyl]sulfanyl}-2-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
| Molecular Weight: | 369.51 |
| Molecular Formula: | C19 H19 N3 O S2 |
| Smiles: | CCc1nnc(c2cc3c(cc(C)s3)n12)SCc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.638 |
| logD: | 4.6375 |
| logSw: | -4.4791 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.8574 |
| InChI Key: | LIEHEOGDFVXHPZ-UHFFFAOYSA-N |