methyl [3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetate
Chemical Structure Depiction of
methyl [3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetate
methyl [3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetate
Compound characteristics
| Compound ID: | C656-0605 |
| Compound Name: | methyl [3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetate |
| Molecular Weight: | 315.29 |
| Molecular Formula: | C14 H13 N5 O4 |
| Smiles: | COC(CN1C=Nc2c(C1=O)nnn2c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5575 |
| logD: | 0.5575 |
| logSw: | -1.7849 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.552 |
| InChI Key: | UYEHCUAJVODDON-UHFFFAOYSA-N |