2-oxo-2H-1-benzopyran-7-yl [(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-oxo-2H-1-benzopyran-7-yl [(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
2-oxo-2H-1-benzopyran-7-yl [(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8007-8646 |
| Compound Name: | 2-oxo-2H-1-benzopyran-7-yl [(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C17 H14 N2 O4 S |
| Smiles: | Cc1cc(C)nc(n1)SCC(=O)Oc1ccc2C=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.45 |
| logD: | 2.45 |
| logSw: | -2.9305 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.335 |
| InChI Key: | NFYWZJARYSFABR-UHFFFAOYSA-N |