8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Chemical Structure Depiction of
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Compound characteristics
| Compound ID: | Y041-1599 |
| Compound Name: | 8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C26 H31 N O6 S |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OC(CCCCCNS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3475 |
| logD: | 5.3475 |
| logSw: | -5.1878 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.071 |
| InChI Key: | WBPJSKLSYRHDRA-UHFFFAOYSA-N |