N-[(4-fluorophenyl)methyl]-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-[(4-fluorophenyl)methyl]-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | C656-0577 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 408.39 |
| Molecular Formula: | C20 H17 F N6 O3 |
| Smiles: | COc1cccc(c1)n1c2c(C(N(CC(NCc3ccc(cc3)F)=O)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.6589 |
| logD: | 1.6589 |
| logSw: | -2.3461 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.174 |
| InChI Key: | NFBBYMLDZCLVJY-UHFFFAOYSA-N |