Chemical ID: 6776664

CCOc1ccccc1N(C)S(=O)(=O)c2ccc3c(c2)c(=O)c(c[nH]3)C(=O)NCc4ccc[nH+]c4
Chemical ID:
6776664
Name [?]:
6-[(2-ethoxyphenyl)-methyl-sulfamoyl]-4-oxo-N-(1H-pyridin-5-ylmethyl)-1H-quinoline-3-carboxamide
SMILES [?]:
CCOc1ccccc1N(C)S(=O)(=O)c2ccc3c(c2)c(=O)c(c[nH]3)C(=O)NCc4ccc[nH+]c4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H25N4O5S+
All Atoms:60
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:-23.6412
Area:721.918
Solvation:-41.6892
Coulombic:-42.2094
Bond Count [?]
All:38
Single:24
Double:14
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:493.556
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.16
LogP (Chemaxon):2.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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