1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methylpropan-1-one
Chemical Structure Depiction of
1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methylpropan-1-one
1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methylpropan-1-one
Compound characteristics
| Compound ID: | V016-5848 |
| Compound Name: | 1-{4-[3-(2-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-methylpropan-1-one |
| Molecular Weight: | 434.93 |
| Molecular Formula: | C23 H23 Cl N6 O |
| Smiles: | CC(C)C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccccc3[Cl])n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1904 |
| logD: | 4.1253 |
| logSw: | -4.4259 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.721 |
| InChI Key: | XUYJUWYGEJSUOG-UHFFFAOYSA-N |