Chemical ID: 4381389

Cc1ccc(cc1)C=C2C(=O)N(C(=S)S2)CCCC(=O)OCCN(C)C
Chemical ID:
4381389
Name [?]:
2-dimethylaminoethyl 4-[4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoate
SMILES [?]:
Cc1ccc(cc1)C=C2C(=O)N(C(=S)S2)CCCC(=O)OCCN(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H24N2O3S2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:12.3692
Area:641.186
Solvation:-3.66049
Coulombic:-41.876
Bond Count [?]
All:27
Single:20
Double:7
Rotors:9
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:392.538
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.34
LogP (Chemaxon):3.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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