5-(3,4-diethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(3,4-diethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(3,4-diethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 8014-9922 |
| Compound Name: | 5-(3,4-diethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C21 H19 N3 O3 S2 |
| Smiles: | CCOc1ccc(cc1OCC)C1NC(C2=C(N=1)N(C(=S)S2)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3521 |
| logD: | 3.3517 |
| logSw: | -3.6168 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.106 |
| InChI Key: | IFGDFTWAJNCHHO-UHFFFAOYSA-N |