ethyl 4-[(3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
ethyl 4-[(3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
Compound characteristics
| Compound ID: | G857-2223 |
| Compound Name: | ethyl 4-[(3-methyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate |
| Molecular Weight: | 298.3 |
| Molecular Formula: | C14 H14 N6 O2 |
| Smiles: | CCOC(c1ccc(cc1)Nc1c2c(ncn1)n(C)nn2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9816 |
| logD: | 1.9815 |
| logSw: | -2.4699 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.967 |
| InChI Key: | YBYLWYDHXILWPP-UHFFFAOYSA-N |