3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
Chemical Structure Depiction of
3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate
Compound characteristics
| Compound ID: | Y041-2451 |
| Compound Name: | 3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl N-(4-methylbenzene-1-sulfonyl)-L-leucinate |
| Molecular Weight: | 512.41 |
| Molecular Formula: | C23 H23 Cl2 N O6 S |
| Smiles: | CC(C)C[C@@H](C(=O)Oc1cc2c(cc1[Cl])C(C)=C(C(=O)O2)[Cl])NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.88 |
| logD: | 5.8799 |
| logSw: | -6.01 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.498 |
| InChI Key: | SVWUXCZHVSSLNI-SFHVURJKSA-N |