5-(4-chlorobenzene-1-sulfonyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Chemical Structure Depiction of
5-(4-chlorobenzene-1-sulfonyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
5-(4-chlorobenzene-1-sulfonyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | C200-2404 |
| Compound Name: | 5-(4-chlorobenzene-1-sulfonyl)-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one |
| Molecular Weight: | 302.75 |
| Molecular Formula: | C10 H7 Cl N2 O3 S2 |
| Smiles: | C1=C(C(NC(N1)=S)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6308 |
| logD: | 1.357 |
| logSw: | -2.6763 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.493 |
| InChI Key: | DWYCCLSLJXIWCE-UHFFFAOYSA-N |