{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(3-methylphenyl)methanone
{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | V004-8819 |
| Compound Name: | {4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 482.97 |
| Molecular Formula: | C27 H23 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)C(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccc(cc3)[Cl])n12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1893 |
| logD: | 5.1281 |
| logSw: | -5.7082 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.449 |
| InChI Key: | LCOKNPWZHKUIRO-UHFFFAOYSA-N |