5-(4-chlorophenyl)-3-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-(4-chlorophenyl)-3-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-(4-chlorophenyl)-3-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | 8015-0725 |
| Compound Name: | 5-(4-chlorophenyl)-3-methyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 309.79 |
| Molecular Formula: | C12 H8 Cl N3 O S2 |
| Smiles: | CN1C2=C(C(NC(c3ccc(cc3)[Cl])=N2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.6662 |
| logD: | 2.6532 |
| logSw: | -3.7245 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.335 |
| InChI Key: | SSYLKRXTOWMCRC-UHFFFAOYSA-N |