[(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
[(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | 8640-0082 |
| Compound Name: | [(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid |
| Molecular Weight: | 326.39 |
| Molecular Formula: | C13 H14 N2 O4 S2 |
| Smiles: | [H]N1C(=Nc2c(C1=O)c1CC(C)(C)OCc1s2)SCC(=O)O[H] |
| Stereo: | ACHIRAL |
| logP: | 1.5227 |
| logD: | -1.0579 |
| logSw: | -2.1382 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.676 |
| InChI Key: | YTHKDBDZPVYZMQ-UHFFFAOYSA-N |