methyl 2-amino-4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
methyl 2-amino-4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | Y501-0240 |
| Compound Name: | methyl 2-amino-4-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C23 H23 N O7 |
| Smiles: | COC(C1C(C2=C(CCCC2=O)OC=1N)c1ccc(COc2ccc(cc2)OC)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9519 |
| logD: | 2.9519 |
| logSw: | -3.4627 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.333 |
| InChI Key: | VFRZCSWCJVIQCZ-HXUWFJFHSA-N |