1-[(2,5-dimethylphenyl)methyl]-3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
1-[(2,5-dimethylphenyl)methyl]-3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1279 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C28 H29 N O5 S |
| Smiles: | CCc1ccc(cc1)S(C1=CN(Cc2cc(C)ccc2C)c2cc(c(cc2C1=O)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.962 |
| logD: | 5.962 |
| logSw: | -5.4569 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.324 |
| InChI Key: | LJTNMINVVOOZTL-UHFFFAOYSA-N |