4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl 4-methylbenzene-1-sulfonate
4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 0688-1920 |
| Compound Name: | 4-(3-methoxyanilino)-2,6-di(propan-2-yl)phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 453.6 |
| Molecular Formula: | C26 H31 N O4 S |
| Smiles: | CC(C)c1cc(cc(C(C)C)c1OS(c1ccc(C)cc1)(=O)=O)Nc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 7.1001 |
| logD: | 7.1 |
| logSw: | -5.8668 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.629 |
| InChI Key: | AQJWTYPOYWXJEV-UHFFFAOYSA-N |