2-amino-4-(2,3-dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,3-dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
2-amino-4-(2,3-dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-6706 |
| Compound Name: | 2-amino-4-(2,3-dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 324.33 |
| Molecular Formula: | C18 H16 N2 O4 |
| Smiles: | COc1cccc(C2C(C#N)=C(N)Oc3cc(ccc23)O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1955 |
| logD: | 2.1952 |
| logSw: | -2.6252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.258 |
| InChI Key: | UEQCCVNCIGCLIK-MRXNPFEDSA-N |