6-amino-8-{4-[(4-methylphenyl)methoxy]phenyl}-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
Chemical Structure Depiction of
6-amino-8-{4-[(4-methylphenyl)methoxy]phenyl}-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
6-amino-8-{4-[(4-methylphenyl)methoxy]phenyl}-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile
Compound characteristics
| Compound ID: | 5948-4236 |
| Compound Name: | 6-amino-8-{4-[(4-methylphenyl)methoxy]phenyl}-2H,8H-[1,3]dioxolo[4,5-g][1]benzopyran-7-carbonitrile |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C25 H20 N2 O4 |
| Smiles: | Cc1ccc(COc2ccc(cc2)C2C(C#N)=C(N)Oc3cc4c(cc23)OCO4)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4021 |
| logD: | 4.4021 |
| logSw: | -4.7155 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.637 |
| InChI Key: | DRBGNAYYVUURPH-XMMPIXPASA-N |