tert-butyl [(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate
Chemical Structure Depiction of
tert-butyl [(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate
tert-butyl [(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 4112-3793 |
| Compound Name: | tert-butyl [(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate |
| Molecular Weight: | 350.5 |
| Molecular Formula: | C17 H22 N2 O2 S2 |
| Smiles: | Cc1nc(c2c3CCCCc3sc2n1)SCC(=O)OC(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.965 |
| logD: | 4.9648 |
| logSw: | -4.7769 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.847 |
| InChI Key: | PPQYRCXELJQTRU-UHFFFAOYSA-N |