7,9-dinitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine
Chemical Structure Depiction of
7,9-dinitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine
7,9-dinitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine
Compound characteristics
Compound ID: | 1634-0056 |
Compound Name: | 7,9-dinitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine |
Molecular Weight: | 312.28 |
Molecular Formula: | C15 H12 N4 O4 |
Smiles: | C1CN=C(c2ccccc2)c2cc(cc(c2N1)[N+]([O-])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.7117 |
logD: | 2.7117 |
logSw: | -3.5034 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.319 |
InChI Key: | YDCUUSHKWPAOTM-UHFFFAOYSA-N |