2-amino-4-{2-[(4-chlorophenyl)methoxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{2-[(4-chlorophenyl)methoxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
2-amino-4-{2-[(4-chlorophenyl)methoxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8015-2182 |
| Compound Name: | 2-amino-4-{2-[(4-chlorophenyl)methoxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile |
| Molecular Weight: | 436.85 |
| Molecular Formula: | C23 H17 Cl N2 O5 |
| Smiles: | C(C1=CC(C2=C(C(C(C#N)=C(N)O2)c2ccccc2OCc2ccc(cc2)[Cl])O1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1266 |
| logD: | 3.1266 |
| logSw: | -3.5108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.024 |
| InChI Key: | CYPQAWJVFHHRBJ-FQEVSTJZSA-N |