5-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
5-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
5-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V028-5574 |
| Compound Name: | 5-{4-[(2-methoxyphenyl)methyl]piperazin-1-yl}-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 495.54 |
| Molecular Formula: | C27 H25 N7 O3 |
| Salt: | not_available |
| Smiles: | COc1ccccc1CN1CCN(CC1)c1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 4.3163 |
| logD: | 4.1178 |
| logSw: | -4.3416 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.244 |
| InChI Key: | COKALOIYVIOOEE-UHFFFAOYSA-N |