(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(furan-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(furan-2-carbonyl)amino]benzoate
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(furan-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G357-1169 |
| Compound Name: | (2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[(furan-2-carbonyl)amino]benzoate |
| Molecular Weight: | 452.49 |
| Molecular Formula: | C22 H20 N4 O5 S |
| Smiles: | CCCCC1=NN2C(=NC(COC(c3ccccc3NC(c3ccco3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8454 |
| logD: | 3.7493 |
| logSw: | -3.9889 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.275 |
| InChI Key: | VHMHJQUTWLESLK-UHFFFAOYSA-N |