(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methoxybenzoate
Chemical Structure Depiction of
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methoxybenzoate
(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methoxybenzoate
Compound characteristics
| Compound ID: | G265-0285 |
| Compound Name: | (2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methoxybenzoate |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C18 H19 N3 O4 S |
| Smiles: | CCCCC1=NN2C(=NC(COC(c3ccccc3OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5319 |
| logD: | 3.531 |
| logSw: | -3.8324 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.934 |
| InChI Key: | XOCSJWOFDPRYQJ-UHFFFAOYSA-N |