8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
Chemical Structure Depiction of
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate
Compound characteristics
| Compound ID: | Y041-1596 |
| Compound Name: | 8-methyl-2-oxo-4-propyl-2H-1-benzopyran-7-yl 2-[(4-methylbenzene-1-sulfonyl)amino]butanoate |
| Molecular Weight: | 457.54 |
| Molecular Formula: | C24 H27 N O6 S |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OC(C(CC)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1397 |
| logD: | 5.1396 |
| logSw: | -5.0614 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.668 |
| InChI Key: | ITVRYVUXKOZPMU-FQEVSTJZSA-N |