2-oxo-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-oxo-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}-2H-1-benzopyran-3-carboxamide
2-oxo-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 4673-0492 |
| Compound Name: | 2-oxo-N-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]phenyl}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C26 H19 N3 O3 S2 |
| Smiles: | C1CCc2c(C1)c1c(ncnc1s2)Sc1ccccc1NC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6718 |
| logD: | 5.6713 |
| logSw: | -6.0475 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.249 |
| InChI Key: | ZMLLEEDSDLPTFB-UHFFFAOYSA-N |