4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
Chemical Structure Depiction of
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
Compound characteristics
| Compound ID: | Y041-1930 |
| Compound Name: | 4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C25 H29 N O6 S |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C(CC)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6198 |
| logD: | 5.6197 |
| logSw: | -5.3801 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.668 |
| InChI Key: | GIPNWMZQIBXIOP-NRFANRHFSA-N |