Chemical ID: 4400177

COCCN1C=C(C(C(=C1)C(=O)OC)c2cccs2)C(=O)OC
Chemical ID:
4400177
Name [?]:
dimethyl 1-(2-methoxyethyl)-4-(2-thienyl)-4H-pyridine-3,5-dicarboxylate
SMILES [?]:
COCCN1C=C(C(C(=C1)C(=O)OC)c2cccs2)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H19NO5S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.27588
Area:509.398
Solvation:-4.45907
Coulombic:-51.9384
Bond Count [?]
All:24
Single:18
Double:6
Rotors:8
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:337.392
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:1.19
LogP (Chemaxon):0.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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