7-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-3326 |
| Compound Name: | 7-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C11 H12 N6 O S3 |
| Smiles: | CCCC1=NN2C(=NC(CSc3nnc(N)s3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.9133 |
| logD: | 1.9113 |
| logSw: | -1.8711 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.837 |
| InChI Key: | GKOZVDCBYCANDI-UHFFFAOYSA-N |