ethyl 1-[9-methyl-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[9-methyl-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-4-carboxylate
ethyl 1-[9-methyl-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V020-3650 |
| Compound Name: | ethyl 1-[9-methyl-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-4-carboxylate |
| Molecular Weight: | 460.49 |
| Molecular Formula: | C24 H24 N6 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)c1nc2ccc(C)cc2c2nnc(c3ccccc3[N+]([O-])=O)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3762 |
| logD: | 4.3645 |
| logSw: | -4.3604 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.827 |
| InChI Key: | NSVUPVQFHIOJAJ-UHFFFAOYSA-N |