4-chloro-N-(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)benzamide
4-chloro-N-(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)benzamide
Compound characteristics
Compound ID: | 8101-0055 |
Compound Name: | 4-chloro-N-(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)benzamide |
Molecular Weight: | 334.78 |
Molecular Formula: | C14 H11 Cl N4 O2 S |
Smiles: | CCC1=NN2C(=NC=C(C2=O)NC(c2ccc(cc2)[Cl])=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.4071 |
logD: | 0.4251 |
logSw: | -3.4113 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.749 |
InChI Key: | YBBIRRLOCABFIH-UHFFFAOYSA-N |