3-chloro-N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}benzamide
3-chloro-N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}benzamide
Compound characteristics
Compound ID: | C679-5840 |
Compound Name: | 3-chloro-N-{3-[(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}benzamide |
Molecular Weight: | 495 |
Molecular Formula: | C25 H23 Cl N4 O3 S |
Smiles: | C1CCC(CC1)C1=NN2C(=NC(COc3cccc(c3)NC(c3cccc(c3)[Cl])=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 5.664 |
logD: | 5.661 |
logSw: | -5.9765 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.782 |
InChI Key: | XNRMEURGYDZWGJ-UHFFFAOYSA-N |