N-(2,3-dimethylphenyl)-N~3~-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-N~3~-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alaninamide
N-(2,3-dimethylphenyl)-N~3~-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | C464-3031 |
| Compound Name: | N-(2,3-dimethylphenyl)-N~3~-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | Cc1cccc(c1C)NC(CCNS(c1ccc2c(CCC(N2)=O)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3033 |
| logD: | 2.302 |
| logSw: | -2.8595 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.11 |
| InChI Key: | JYDBMTFKGIPSTP-UHFFFAOYSA-N |