N-[(2-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
N-[(2-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
Compound characteristics
| Compound ID: | C684-0085 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide |
| Molecular Weight: | 495.97 |
| Molecular Formula: | C27 H22 Cl N7 O |
| Smiles: | C(CC(NCc1ccccc1[Cl])=O)Cc1nnc2n1c1ccccc1c1nc(c3ccccc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 4.2843 |
| logD: | 3.8716 |
| logSw: | -4.4691 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.841 |
| InChI Key: | VINRAHRWBJLFKQ-UHFFFAOYSA-N |