Chemical ID: 6807353

CC(C)c1ccc2c(c1)c(cc(n2)c3ccc(cc3)OC)C(=O)NCc4ccc[nH+]c4
Chemical ID:
6807353
Name [?]:
6-isopropyl-2-(4-methoxyphenyl)-N-(1H-pyridin-5-ylmethyl)quinoline-4-carboxamide
SMILES [?]:
CC(C)c1ccc2c(c1)c(cc(n2)c3ccc(cc3)OC)C(=O)NCc4ccc[nH+]c4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H26N3O2+
All Atoms:57
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:-21.2688
Area:667.085
Solvation:-37.9459
Coulombic:-25.789
Bond Count [?]
All:34
Single:22
Double:12
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:412.504
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.34
LogP (Chemaxon):4.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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