2-[(6-bromo-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-3(7H)-yl)methoxy]ethyl acetate
Chemical Structure Depiction of
2-[(6-bromo-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-3(7H)-yl)methoxy]ethyl acetate
2-[(6-bromo-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-3(7H)-yl)methoxy]ethyl acetate
Compound characteristics
| Compound ID: | 2111-0107 |
| Compound Name: | 2-[(6-bromo-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-3(7H)-yl)methoxy]ethyl acetate |
| Molecular Weight: | 345.15 |
| Molecular Formula: | C11 H13 Br N4 O4 |
| Smiles: | CC1=C(C(N2C(=N1)N(COCCOC(C)=O)C=N2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | -0.4813 |
| logD: | -0.5015 |
| logSw: | -0.128 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.717 |
| InChI Key: | PNKODEMNTXNOPE-UHFFFAOYSA-N |