N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0653 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 487.49 |
| Molecular Formula: | C26 H22 F N5 O4 |
| Smiles: | COc1ccc(CCNC(c2ccc3C(Nc4c(c5cccc(c5)F)nnn4c3c2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6452 |
| logD: | 2.6444 |
| logSw: | -3.2624 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.746 |
| InChI Key: | DQBQEEDXPUOYBJ-UHFFFAOYSA-N |