3-(4-chlorophenyl)-5-[(2-phenoxyethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-5-[(2-phenoxyethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
3-(4-chlorophenyl)-5-[(2-phenoxyethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | F092-0139 |
| Compound Name: | 3-(4-chlorophenyl)-5-[(2-phenoxyethyl)sulfanyl]-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 447.98 |
| Molecular Formula: | C19 H14 Cl N3 O2 S3 |
| Smiles: | C(CSC1NC(C2=C(N=1)N(C(=S)S2)c1ccc(cc1)[Cl])=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5514 |
| logD: | 4.5497 |
| logSw: | -4.8654 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.714 |
| InChI Key: | LYUQWYXIGJGAAX-UHFFFAOYSA-N |