[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](3-nitrophenyl)methanone
Chemical Structure Depiction of
[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](3-nitrophenyl)methanone
[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | F019-2902 |
| Compound Name: | [5-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl](3-nitrophenyl)methanone |
| Molecular Weight: | 489.92 |
| Molecular Formula: | C25 H20 Cl N5 O4 |
| Smiles: | COc1ccc(cc1)C1CC(c2ccc(cc2)[Cl])N(C(c2cccc(c2)[N+]([O-])=O)=O)c2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9753 |
| logD: | 4.9753 |
| logSw: | -5.4923 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.164 |
| InChI Key: | AYVHQCQJMSUCMJ-UHFFFAOYSA-N |