Chemical ID: 5843535

CCN1C(=O)C(=Cc2ccc(cc2)C#N)SC1=Nc3ccc(cc3)F
Chemical ID:
5843535
Name [?]:
4-[[3-ethyl-2-(4-fluorophenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]benzonitrile
SMILES [?]:
CCN1C(=O)C(=Cc2ccc(cc2)C#N)SC1=Nc3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H14FN3OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.2263
Area:532.658
Solvation:-3.09018
Coulombic:-32.3549
Bond Count [?]
All:27
Single:17
Double:9
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:351.398
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.54
LogP (Chemaxon):4.9

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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