N-[(4-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
N-[(4-chlorophenyl)methyl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butanamide
Compound characteristics
| Compound ID: | C684-0093 |
| Compound Name: | N-[(4-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(NCc1ccc(cc1)[Cl])=O)Cc1nnc2n1c1ccccc1c1nc(c3ccccc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 4.097 |
| logD: | 3.6843 |
| logSw: | -4.6232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.841 |
| InChI Key: | ASIRDXYUSGBAKP-UHFFFAOYSA-N |