(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(2-methoxybenzamido)benzoate
Chemical Structure Depiction of
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(2-methoxybenzamido)benzoate
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(2-methoxybenzamido)benzoate
Compound characteristics
| Compound ID: | G357-1046 |
| Compound Name: | (2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(2-methoxybenzamido)benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CCCCC1=NN2C(=NC(COC(c3ccc(cc3)NC(c3ccccc3OC)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.5329 |
| logD: | 4.4731 |
| logSw: | -4.5146 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.025 |
| InChI Key: | PJBIGFGEIHPOIC-UHFFFAOYSA-N |