7-{[(2-aminophenyl)sulfanyl]methyl}-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[(2-aminophenyl)sulfanyl]methyl}-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[(2-aminophenyl)sulfanyl]methyl}-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
Compound ID: | G072-0025 |
Compound Name: | 7-{[(2-aminophenyl)sulfanyl]methyl}-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
Molecular Weight: | 304.39 |
Molecular Formula: | C13 H12 N4 O S2 |
Smiles: | CC1=NN2C(=NC(CSc3ccccc3N)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.0795 |
logD: | 2.0771 |
logSw: | -2.356 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.54 |
InChI Key: | RIKSRURKAUHGKD-UHFFFAOYSA-N |