N-[3-(cyclohexylsulfanyl)propyl]-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-[3-(cyclohexylsulfanyl)propyl]-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | K788-1293 |
Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide |
Molecular Weight: | 529.68 |
Molecular Formula: | C26 H31 N3 O5 S2 |
Smiles: | COc1cccc(c1)NS(c1ccc2c(c1)C(C(=CN2)C(NCCCSC1CCCCC1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2116 |
logD: | 3.1506 |
logSw: | -4.3741 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 96.998 |
InChI Key: | QGGBONNOLCEFTM-UHFFFAOYSA-N |