[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4,5-trimethoxybenzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | G265-0106 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C19 H21 N3 O6 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3cc(c(c(c3)OC)OC)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.7862 |
| logD: | 2.7779 |
| logSw: | -3.1404 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.378 |
| InChI Key: | PMXAQTCFRGJSDR-UHFFFAOYSA-N |