1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(10-methylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Chemical Structure Depiction of
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(10-methylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(10-methylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one
Compound characteristics
| Compound ID: | C684-0059 |
| Compound Name: | 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-(10-methylbis[1,2,4]triazolo[4,3-a:1',5'-c]quinazolin-3-yl)butan-1-one |
| Molecular Weight: | 482.59 |
| Molecular Formula: | C27 H30 N8 O |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CCCc1nnc2n1c1ccccc1c1nc(C)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1823 |
| logD: | 2.4268 |
| logSw: | -3.2529 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 63.606 |
| InChI Key: | LGBBTVXEMGPCTQ-UHFFFAOYSA-N |