Chemical ID: 6776548

CCC(C)NC(=O)c1cnc2ccc(cc2c1O)S(=O)(=O)N(C)c3ccc(cc3)OCC
Chemical ID:
6776548
Name [?]:
6-[(4-ethoxyphenyl)-methyl-sulfamoyl]-4-hydroxy-N-sec-butyl-quinoline-3-carboxamide
SMILES [?]:
CCC(C)NC(=O)c1cnc2ccc(cc2c1O)S(=O)(=O)N(C)c3ccc(cc3)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H27N3O5S
All Atoms:59
Heavy Atoms:32
Chiral Atoms:2
ZAP Information [?]
Total:11.4228
Area:687.63
Solvation:-5.76795
Coulombic:-55.9362
Bond Count [?]
All:34
Single:23
Double:11
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:457.544
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.39
LogP (Chemaxon):3.52

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue