N,N-diethyl-1-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N,N-diethyl-1-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-3-carboxamide
N,N-diethyl-1-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | V029-0166 |
| Compound Name: | N,N-diethyl-1-[3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperidine-3-carboxamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C25 H27 N7 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)C(C1CCCN(C1)c1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5509 |
| logD: | 3.5453 |
| logSw: | -3.9286 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.939 |
| InChI Key: | JQZAVDQSODITBH-KRWDZBQOSA-N |