N-[2-(methylsulfanyl)phenyl]-2-(morpholin-4-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[2-(methylsulfanyl)phenyl]-2-(morpholin-4-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[2-(methylsulfanyl)phenyl]-2-(morpholin-4-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | C796-0888 |
Compound Name: | N-[2-(methylsulfanyl)phenyl]-2-(morpholin-4-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 403.48 |
Molecular Formula: | C17 H17 N5 O3 S2 |
Smiles: | CSc1ccccc1NC(C1=CN=C2N(C1=O)N=C(N1CCOCC1)S2)=O |
Stereo: | ACHIRAL |
logP: | 1.5868 |
logD: | 1.1223 |
logSw: | -2.368 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.129 |
InChI Key: | GXINNKGLPRTWNW-UHFFFAOYSA-N |