7-{[(2-aminoethyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(2-aminoethyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[(2-aminoethyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | Y042-7748 |
| Compound Name: | 7-{[(2-aminoethyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 242.32 |
| Molecular Formula: | C8 H10 N4 O S2 |
| Smiles: | C(CSCC1=CC(N2C(=N1)SC=N2)=O)N |
| Stereo: | ACHIRAL |
| logP: | -0.3948 |
| logD: | -2.2821 |
| logSw: | -0.8651 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.867 |
| InChI Key: | NXXBUFMBCUHFBN-UHFFFAOYSA-N |