2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Chemical Structure Depiction of
2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Compound characteristics
| Compound ID: | Y041-1639 |
| Compound Name: | 2-oxo-4-propyl-2H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C25 H29 N O6 S |
| Smiles: | CCCC1=CC(=O)Oc2cc(ccc12)OC(CCCCCNS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8251 |
| logD: | 4.8251 |
| logSw: | -4.573 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.3 |
| InChI Key: | IQRATXKRRUWGGU-UHFFFAOYSA-N |