5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-methyl[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-methyl[1,2,4]triazolo[4,3-c]quinazoline
5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-methyl[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | E881-0010 |
| Compound Name: | 5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-methyl[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 392.89 |
| Molecular Formula: | C21 H21 Cl N6 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)c1nc2ccccc2c2nnc(C)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3978 |
| logD: | 4.2526 |
| logSw: | -4.5094 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.001 |
| InChI Key: | PBDGMZMVRASOPQ-UHFFFAOYSA-N |