N-[(furan-2-yl)methyl]-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-amine
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-amine
N-[(furan-2-yl)methyl]-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-amine
Compound characteristics
| Compound ID: | V025-8834 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-(2-nitrophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-amine |
| Molecular Weight: | 386.37 |
| Molecular Formula: | C20 H14 N6 O3 |
| Smiles: | C(c1ccco1)Nc1nc2ccccc2c2nnc(c3ccccc3[N+]([O-])=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 3.6868 |
| logD: | 3.6843 |
| logSw: | -4.3264 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.971 |
| InChI Key: | PGHUFNSLHQUOPT-UHFFFAOYSA-N |