N-(3-chloro-4-methoxyphenyl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
N-(3-chloro-4-methoxyphenyl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | E589-4847 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-N~3~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 435.88 |
| Molecular Formula: | C19 H18 Cl N3 O5 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CCNS(c1ccc2c(C=CC(N2)=O)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6576 |
| logD: | 2.6514 |
| logSw: | -3.326 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.439 |
| InChI Key: | BAUGRXWOTGPPLE-UHFFFAOYSA-N |