[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate
Compound characteristics
| Compound ID: | G265-0104 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 3,4-dimethoxybenzoate |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C18 H19 N3 O5 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccc(c(c3)OC)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.8588 |
| logD: | 2.8505 |
| logSw: | -3.2584 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.661 |
| InChI Key: | KTPZIRAVPPGBQZ-UHFFFAOYSA-N |