7-(azepan-1-yl)-1-benzyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
7-(azepan-1-yl)-1-benzyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
7-(azepan-1-yl)-1-benzyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0583 |
| Compound Name: | 7-(azepan-1-yl)-1-benzyl-6-fluoro-3-(3-methylbenzene-1-sulfonyl)quinolin-4(1H)-one |
| Molecular Weight: | 504.62 |
| Molecular Formula: | C29 H29 F N2 O3 S |
| Smiles: | Cc1cccc(c1)S(C1=CN(Cc2ccccc2)c2cc(c(cc2C1=O)F)N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5369 |
| logD: | 5.5369 |
| logSw: | -5.381 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.546 |
| InChI Key: | RKNAKSGXZPFTNR-UHFFFAOYSA-N |