methyl {[5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
methyl {[5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8640-0447 |
| Compound Name: | methyl {[5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C17 H20 N4 O3 S3 |
| Smiles: | CC(C)C1Cc2c3c4nnc(n4C(=Nc3sc2CO1)SC)SCC(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2391 |
| logD: | 3.2391 |
| logSw: | -3.4701 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.227 |
| InChI Key: | SYDRLZDHHYPKGZ-SNVBAGLBSA-N |