methyl 4-(2-amino-3-cyano-4H-naphtho[1,2-b]pyran-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(2-amino-3-cyano-4H-naphtho[1,2-b]pyran-4-yl)benzoate
methyl 4-(2-amino-3-cyano-4H-naphtho[1,2-b]pyran-4-yl)benzoate
Compound characteristics
| Compound ID: | 8020-0852 |
| Compound Name: | methyl 4-(2-amino-3-cyano-4H-naphtho[1,2-b]pyran-4-yl)benzoate |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C22 H16 N2 O3 |
| Smiles: | COC(c1ccc(cc1)C1C(C#N)=C(N)Oc2c1ccc1ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1665 |
| logD: | 4.1665 |
| logSw: | -4.7299 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.88 |
| InChI Key: | CCGKDWATTIAHEI-IBGZPJMESA-N |