5,5'-[(3,4,5-trimethoxyphenyl)methylene]bis(6-hydroxy-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one)
Chemical Structure Depiction of
5,5'-[(3,4,5-trimethoxyphenyl)methylene]bis(6-hydroxy-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one)
5,5'-[(3,4,5-trimethoxyphenyl)methylene]bis(6-hydroxy-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one)
Compound characteristics
| Compound ID: | 3739-0063 |
| Compound Name: | 5,5'-[(3,4,5-trimethoxyphenyl)methylene]bis(6-hydroxy-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one) |
| Molecular Weight: | 466.49 |
| Molecular Formula: | C18 H18 N4 O7 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)C(C1=C(NC(NC1=O)=S)O)C1=C(NC(NC1=O)=S)O |
| Stereo: | ACHIRAL |
| logP: | 0.2827 |
| logD: | -3.1028 |
| logSw: | -2.18 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 126.746 |
| InChI Key: | BAOQMIPHLVPZPN-UHFFFAOYSA-N |