4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl (2S)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
Chemical Structure Depiction of
4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl (2S)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl (2S)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate
Compound characteristics
| Compound ID: | Y043-7933 |
| Compound Name: | 4-methyl-2-oxo-3-propyl-2H-1-benzopyran-7-yl (2S)-[(4-methylbenzene-1-sulfonyl)amino](phenyl)acetate |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C28 H27 N O6 S |
| Smiles: | CCCC1=C(C)c2ccc(cc2OC1=O)OC([C@H](c1ccccc1)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.7737 |
| logD: | 5.7729 |
| logSw: | -5.5694 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.862 |
| InChI Key: | LIRRRZVNGDMUFZ-AREMUKBSSA-N |