1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Chemical Structure Depiction of
1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Compound characteristics
| Compound ID: | C684-0102 |
| Compound Name: | 1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-(10-phenylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one |
| Molecular Weight: | 546.63 |
| Molecular Formula: | C31 H30 N8 O2 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CCCc1nnc2n1c1ccccc1c1nc(c3ccccc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8438 |
| logD: | 3.431 |
| logSw: | -4.0772 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.352 |
| InChI Key: | NGNZAHDHNUUDHU-UHFFFAOYSA-N |