4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butan-1-one
Chemical Structure Depiction of
4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butan-1-one
4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butan-1-one
Compound characteristics
| Compound ID: | C684-0100 |
| Compound Name: | 4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)-1-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butan-1-one |
| Molecular Weight: | 513.6 |
| Molecular Formula: | C31 H27 N7 O |
| Smiles: | C(CC(N1CCC(=CC1)c1ccccc1)=O)Cc1nnc2n1c1ccccc1c1nc(c3ccccc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 4.7749 |
| logD: | 4.3621 |
| logSw: | -5.0218 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.49 |
| InChI Key: | LCBOCVRDCYTROH-UHFFFAOYSA-N |