Chemical ID: 4291030

CCOC(=O)C1=C(NC2=C(C1c3ccc(cc3Cl)Cl)C(=O)CCC2)C
Chemical ID:
4291030
Name [?]:
ethyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SMILES [?]:
CCOC(=O)C1=C(NC2=C(C1c3ccc(cc3Cl)Cl)C(=O)CCC2)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H19Cl2NO3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:10.6113
Area:534.273
Solvation:-2.74558
Coulombic:-38.5289
Bond Count [?]
All:27
Single:20
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:380.264
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.86
LogP (Chemaxon):2.38

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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