Chemical ID: 4522117

CC1=C(C(C2=C(N1)CCCC2=O)c3ccncc3)C(=O)OC4CCCC4
Chemical ID:
4522117
Name [?]:
cyclopentyl 2-methyl-5-oxo-4-(4-pyridyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SMILES [?]:
CC1=C(C(C2=C(N1)CCCC2=O)c3ccncc3)C(=O)OC4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24N2O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:9.37601
Area:508.406
Solvation:-3.33415
Coulombic:-41.568
Bond Count [?]
All:29
Single:22
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:352.427
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.2
LogP (Chemaxon):0.88

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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