2-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-4-yl)-6-methoxyphenyl morpholine-4-carboxylate
Chemical Structure Depiction of
2-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-4-yl)-6-methoxyphenyl morpholine-4-carboxylate
2-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-4-yl)-6-methoxyphenyl morpholine-4-carboxylate
Compound characteristics
| Compound ID: | 8010-8467 |
| Compound Name: | 2-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-4-yl)-6-methoxyphenyl morpholine-4-carboxylate |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C22 H23 N3 O6 |
| Smiles: | COc1cccc(C2C(C#N)=C(N)OC3CCCC(C2=3)=O)c1OC(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.52 |
| logD: | 1.52 |
| logSw: | -1.986 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.911 |
| InChI Key: | WDOVMVGDDLTBDD-GOSISDBHSA-N |