3-(4-bromophenyl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
3-(4-bromophenyl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
3-(4-bromophenyl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0813 |
| Compound Name: | 3-(4-bromophenyl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 478.3 |
| Molecular Formula: | C22 H16 Br N5 O3 |
| Smiles: | Cc1ccc(CNC(c2ccc3C(Nc4c(c5ccc(cc5)[Br])nnn4c3c2)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8767 |
| logD: | 3.8766 |
| logSw: | -4.0315 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.907 |
| InChI Key: | AOLDLCVLEJCRHU-UHFFFAOYSA-N |