N-[(2,4-dioxo-2H-1-benzopyran-3(4H)-ylidene)methyl]serine
Chemical Structure Depiction of
N-[(2,4-dioxo-2H-1-benzopyran-3(4H)-ylidene)methyl]serine
N-[(2,4-dioxo-2H-1-benzopyran-3(4H)-ylidene)methyl]serine
Compound characteristics
| Compound ID: | 7009-0654 |
| Compound Name: | N-[(2,4-dioxo-2H-1-benzopyran-3(4H)-ylidene)methyl]serine |
| Molecular Weight: | 277.23 |
| Molecular Formula: | C13 H11 N O6 |
| Smiles: | C(C(C(O)=O)N/C=C1/C(c2ccccc2OC1=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.9598 |
| logD: | -3.7907 |
| logSw: | -2.0867 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.383 |
| InChI Key: | VKLQWLWCTDKNRQ-VIFPVBQESA-N |