5-(4-methoxyphenyl)-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(4-methoxyphenyl)-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(4-methoxyphenyl)-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 8014-9091 |
| Compound Name: | 5-(4-methoxyphenyl)-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C15 H13 N3 O2 S2 |
| Smiles: | COc1ccc(cc1)C1NC(C2=C(N=1)N(CC=C)C(=S)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7776 |
| logD: | 2.7772 |
| logSw: | -3.3964 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.091 |
| InChI Key: | RDXGBEXUGPKMNJ-UHFFFAOYSA-N |