1,3-diamino-10-(3-nitrophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
Chemical Structure Depiction of
1,3-diamino-10-(3-nitrophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
1,3-diamino-10-(3-nitrophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile
Compound characteristics
| Compound ID: | 8020-3564 |
| Compound Name: | 1,3-diamino-10-(3-nitrophenyl)-9-oxo-6,8,9,10-tetrahydro-7H-[1]benzopyrano[3,2-c]pyridine-4-carbonitrile |
| Molecular Weight: | 377.36 |
| Molecular Formula: | C19 H15 N5 O4 |
| Smiles: | C1CC2=C(C(c3cccc(c3)[N+]([O-])=O)c3c(c(C#N)c(N)nc3N)O2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8435 |
| logD: | 1.8435 |
| logSw: | -2.4252 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 120.22 |
| InChI Key: | KWKXSSMFYGAWNZ-CQSZACIVSA-N |