1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methoxyethan-1-one
Chemical Structure Depiction of
1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methoxyethan-1-one
1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | V018-3738 |
| Compound Name: | 1-{4-[8-chloro-3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methoxyethan-1-one |
| Molecular Weight: | 471.34 |
| Molecular Formula: | C22 H20 Cl2 N6 O2 |
| Smiles: | COCC(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3ccccc3[Cl])n12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6101 |
| logD: | 3.5449 |
| logSw: | -3.8568 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.617 |
| InChI Key: | JQKROHMQETYJMH-UHFFFAOYSA-N |