7-{[(4-chlorophenyl)sulfanyl]methyl}-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(4-chlorophenyl)sulfanyl]methyl}-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[(4-chlorophenyl)sulfanyl]methyl}-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2689 |
| Compound Name: | 7-{[(4-chlorophenyl)sulfanyl]methyl}-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 391.92 |
| Molecular Formula: | C16 H10 Cl N3 O S3 |
| Smiles: | C(C1=CC(N2C(=N1)SC(c1cccs1)=N2)=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5045 |
| logD: | 4.5045 |
| logSw: | -4.8121 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.018 |
| InChI Key: | PZZKFWYFMMATPS-UHFFFAOYSA-N |