N-(2-methoxyphenyl)-2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
N-(2-methoxyphenyl)-2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 6280-0694 |
| Compound Name: | N-(2-methoxyphenyl)-2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 486.64 |
| Molecular Formula: | C21 H22 N6 O2 S3 |
| Smiles: | CN1CCc2c3c4nnc(n4C(=Nc3sc2C1)SC)SCC(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7047 |
| logD: | 2.6992 |
| logSw: | -3.1605 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.516 |
| InChI Key: | JNISJIUGSYZRSH-UHFFFAOYSA-N |