1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V004-8807 |
| Compound Name: | 1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 489 |
| Molecular Formula: | C25 H21 Cl N6 O S |
| Salt: | not_available |
| Smiles: | C(C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccc(cc3)[Cl])n12)=O)c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.7328 |
| logD: | 4.6717 |
| logSw: | -5.0868 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.94 |
| InChI Key: | MOOQDPPIVQSHPQ-UHFFFAOYSA-N |