3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl (2R)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
Chemical Structure Depiction of
3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl (2R)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl (2R)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
Compound characteristics
| Compound ID: | Y041-2453 |
| Compound Name: | 3,6-dichloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl (2R)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate |
| Molecular Weight: | 532.4 |
| Molecular Formula: | C25 H19 Cl2 N O6 S |
| Smiles: | CC1=C(C(=O)Oc2cc(c(cc12)[Cl])OC([C@@H](c1ccccc1)NS(c1ccc(C)cc1)(=O)=O)=O)[Cl] |
| Stereo: | ABSOLUTE |
| logP: | 5.6689 |
| logD: | 5.6682 |
| logSw: | -6.0359 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.948 |
| InChI Key: | HJBMQKNQQYNDKB-HSZRJFAPSA-N |