2-amino-5-hydroxy-4-(3-nitrophenyl)-8-[(phenylimino)methyl]-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-hydroxy-4-(3-nitrophenyl)-8-[(phenylimino)methyl]-4H-1-benzopyran-3-carbonitrile
2-amino-5-hydroxy-4-(3-nitrophenyl)-8-[(phenylimino)methyl]-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8006-4451 |
| Compound Name: | 2-amino-5-hydroxy-4-(3-nitrophenyl)-8-[(phenylimino)methyl]-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 412.4 |
| Molecular Formula: | C23 H16 N4 O4 |
| Smiles: | C(/c1ccc(c2C(C(C#N)=C(N)Oc12)c1cccc(c1)[N+]([O-])=O)O)=N/c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7697 |
| logD: | 3.7696 |
| logSw: | -3.9362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.035 |
| InChI Key: | OBWKMZMGHCDSOA-HXUWFJFHSA-N |