N-heptyl-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
N-heptyl-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
N-heptyl-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
Compound ID: | K786-4877 |
Compound Name: | N-heptyl-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide |
Molecular Weight: | 419.54 |
Molecular Formula: | C21 H29 N3 O4 S |
Smiles: | CCCCCCCNC(C1=CC(Nc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4113 |
logD: | 3.3691 |
logSw: | -3.7806 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.663 |
InChI Key: | NZHPDJDJEATDST-UHFFFAOYSA-N |