[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl [(4-chlorophenyl)sulfanyl]acetate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl [(4-chlorophenyl)sulfanyl]acetate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl [(4-chlorophenyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | G265-0716 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl [(4-chlorophenyl)sulfanyl]acetate |
| Molecular Weight: | 449.95 |
| Molecular Formula: | C18 H12 Cl N3 O3 S3 |
| Smiles: | C(C1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)OC(CSc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2398 |
| logD: | 4.2398 |
| logSw: | -4.6078 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.552 |
| InChI Key: | PSXAANIVSVSFAI-UHFFFAOYSA-N |