ethyl 3-{[N-methyl-N-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[N-methyl-N-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycyl]amino}benzoate
ethyl 3-{[N-methyl-N-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycyl]amino}benzoate
Compound characteristics
| Compound ID: | E589-4549 |
| Compound Name: | ethyl 3-{[N-methyl-N-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycyl]amino}benzoate |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C21 H21 N3 O6 S |
| Smiles: | CCOC(c1cccc(c1)NC(CN(C)S(c1ccc2c(C=CC(N2)=O)c1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1403 |
| logD: | 3.1341 |
| logSw: | -3.3778 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.526 |
| InChI Key: | PPNCNSHYFRCWNL-UHFFFAOYSA-N |