[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | G265-0228 |
| Compound Name: | [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C19 H21 N3 O5 S |
| Smiles: | CC(C)CC1=NN2C(=NC(COC(c3ccc(c(c3)OC)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.2503 |
| logD: | 3.2478 |
| logSw: | -3.4664 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.564 |
| InChI Key: | QLQDWMDJNGNUII-UHFFFAOYSA-N |