Chemical ID: 4179253

CCC1=C(C(C2=C(N1)CCCC2=O)c3ccccc3)C(=O)OCC
Chemical ID:
4179253
Name [?]:
ethyl 2-ethyl-5-oxo-4-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SMILES [?]:
CCC1=C(C(C2=C(N1)CCCC2=O)c3ccccc3)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H23NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:9.46709
Area:498.421
Solvation:-2.99344
Coulombic:-38.5841
Bond Count [?]
All:26
Single:19
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.402
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.87
LogP (Chemaxon):1.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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