2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-phenylalaninate
Chemical Structure Depiction of
2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-phenylalaninate
2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-phenylalaninate
Compound characteristics
| Compound ID: | Y042-8327 |
| Compound Name: | 2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-phenylalaninate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H21 N O6 S |
| Smiles: | Cc1ccc(cc1)S(N[C@@H](Cc1ccccc1)C(=O)Oc1ccc2C=CC(=O)Oc2c1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 4.4698 |
| logD: | 4.4698 |
| logSw: | -4.4823 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.626 |
| InChI Key: | BWQMULHTWTVJGT-QFIPXVFZSA-N |