(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-ethylbutanamido)benzoate
Chemical Structure Depiction of
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-ethylbutanamido)benzoate
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-ethylbutanamido)benzoate
Compound characteristics
| Compound ID: | G357-1103 |
| Compound Name: | (2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-ethylbutanamido)benzoate |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C23 H28 N4 O4 S |
| Smiles: | CCCCC1=NN2C(=NC(COC(c3cccc(c3)NC(C(CC)CC)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.8769 |
| logD: | 4.876 |
| logSw: | -4.6547 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.666 |
| InChI Key: | SYZPSGCWLOWVES-UHFFFAOYSA-N |