5-(2H-1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(2H-1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 8016-7020 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C18 H11 N3 O3 S2 |
| Smiles: | C1Oc2ccc(cc2O1)C1NC(C2=C(N=1)N(C(=S)S2)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.159 |
| logD: | 3.1586 |
| logSw: | -3.4572 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.801 |
| InChI Key: | OVLHHZKMWPBWGJ-UHFFFAOYSA-N |