3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate
Compound characteristics
| Compound ID: | Y040-8048 |
| Compound Name: | 3-(4-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 6-[(4-methylbenzene-1-sulfonyl)amino]hexanoate |
| Molecular Weight: | 540.03 |
| Molecular Formula: | C28 H26 Cl N O6 S |
| Smiles: | Cc1ccc(cc1)S(NCCCCCC(=O)Oc1ccc2C(C(=COc2c1)c1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5507 |
| logD: | 5.5506 |
| logSw: | -5.8092 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.514 |
| InChI Key: | ZWDSCSKZAKVYSP-UHFFFAOYSA-N |