(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-trimethoxybenzoate
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | G265-0044 |
| Compound Name: | (2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 391.4 |
| Molecular Formula: | C17 H17 N3 O6 S |
| Smiles: | CC1=NN2C(=NC(COC(c3cc(c(c(c3)OC)OC)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.9606 |
| logD: | 1.9555 |
| logSw: | -2.2468 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.551 |
| InChI Key: | BFZGNRQAEBLIBH-UHFFFAOYSA-N |