Chemical ID: 6751352

CCOC(=O)c1cnc2c(c1Nc3ccc(cc3)C(=O)[O-])cccc2C(F)(F)F
Chemical ID:
6751352
Name [?]:
4-[[3-ethoxycarbonyl-8-(trifluoromethyl)-4-quinolyl]amino]benzoate
SMILES [?]:
CCOC(=O)c1cnc2c(c1Nc3ccc(cc3)C(=O)[O-])cccc2C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H14F3N2O4-
All Atoms:43
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:-30.5276
Area:574.58
Solvation:-44.8921
Coulombic:-55.3449
Bond Count [?]
All:31
Single:21
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:403.331
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.18
LogP (Chemaxon):3.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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