Chemical ID: 6702645

CCOC(=O)c1cnc2ccc(cc2c1Nc3ccc(cc3)C(=O)[O-])C
Chemical ID:
6702645
Name [?]:
4-[(3-ethoxycarbonyl-6-methyl-4-quinolyl)amino]benzoate
SMILES [?]:
CCOC(=O)c1cnc2ccc(cc2c1Nc3ccc(cc3)C(=O)[O-])C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H17N2O4-
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:-30.6267
Area:560.636
Solvation:-44.6426
Coulombic:-36.7414
Bond Count [?]
All:28
Single:18
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:349.36
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.7
LogP (Chemaxon):2.68

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