2-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
2-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | 8640-0385 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine |
| Molecular Weight: | 401.5 |
| Molecular Formula: | C19 H19 N3 O3 S2 |
| Smiles: | [H]N([H])c1c2c3CC(C)(C)OCc3sc2nc(n1)SCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.5573 |
| logD: | 4.5573 |
| logSw: | -4.8951 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.794 |
| InChI Key: | JMSFKJHIQGQCQX-UHFFFAOYSA-N |