ethyl N-{[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}glycinate
Chemical Structure Depiction of
ethyl N-{[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}glycinate
ethyl N-{[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}glycinate
Compound characteristics
| Compound ID: | C656-0497 |
| Compound Name: | ethyl N-{[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetyl}glycinate |
| Molecular Weight: | 390.78 |
| Molecular Formula: | C16 H15 Cl N6 O4 |
| Smiles: | CCOC(CNC(CN1C=Nc2c(C1=O)nnn2c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9269 |
| logD: | 0.9269 |
| logSw: | -2.5633 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.06 |
| InChI Key: | FBOCQEUIXUUCPV-UHFFFAOYSA-N |