5-(anilinomethyl)-2-(3,4-difluorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-(anilinomethyl)-2-(3,4-difluorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-(anilinomethyl)-2-(3,4-difluorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D489-0213 |
| Compound Name: | 5-(anilinomethyl)-2-(3,4-difluorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 353.33 |
| Molecular Formula: | C18 H13 F2 N5 O |
| Smiles: | C(C1=CC(n2c(N1)nc(c1ccc(c(c1)F)F)n2)=O)Nc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4529 |
| logD: | 3.2498 |
| logSw: | -3.8279 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.575 |
| InChI Key: | FLJUGAFDMVEDKV-UHFFFAOYSA-N |