2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 8640-0287 |
| Compound Name: | 2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide |
| Molecular Weight: | 459.65 |
| Molecular Formula: | C22 H25 N3 O2 S3 |
| Smiles: | [H]N(C(CSc1c2c3CC(C)(CC)OCc3sc2nc(n1)SC)=O)c1ccccc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6584 |
| logD: | 5.6584 |
| logSw: | -5.7057 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.76 |
| InChI Key: | RRJNKOBMQYGAOW-QFIPXVFZSA-N |