(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G357-3575 |
| Compound Name: | (5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C21 H18 N4 O4 S2 |
| Smiles: | CCCC1=NN2C(=NC(COC(c3cccc(c3)NC(c3cccs3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3616 |
| logD: | 4.3576 |
| logSw: | -4.3829 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.413 |
| InChI Key: | ZDFQMARJBQRYOG-UHFFFAOYSA-N |