N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-2113 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 520.4 |
| Molecular Formula: | C22 H22 Br N3 O5 S |
| Smiles: | COc1ccc(cc1CNC(C1=CC(Nc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.0712 |
| logD: | 3.0291 |
| logSw: | -3.5976 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.18 |
| InChI Key: | VBLVYZVVILSNDJ-UHFFFAOYSA-N |