5-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
5-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
5-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V023-9525 |
| Compound Name: | 5-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 499.96 |
| Molecular Formula: | C26 H22 Cl N7 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1Cc1ccc(cc1)[Cl])c1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.8049 |
| logD: | 4.7431 |
| logSw: | -5.0456 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.614 |
| InChI Key: | CHZPDIPRSMTWQD-UHFFFAOYSA-N |