Chemical ID: 4184202

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)c3ccncc3)C(=O)OC4CCCC4
Chemical ID:
4184202
Name [?]:
cyclopentyl 2,7,7-trimethyl-5-oxo-4-(4-pyridyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
SMILES [?]:
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)c3ccncc3)C(=O)OC4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H28N2O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:10.3524
Area:544.946
Solvation:-3.27122
Coulombic:-42.2875
Bond Count [?]
All:31
Single:24
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:380.48
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.31
LogP (Chemaxon):1.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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