Chemical ID: 4453539

CCN(CC)c1ccc(cc1)C=C2C(=O)NC(=Nc3cccc(c3C)Cl)S2
Chemical ID:
4453539
Name [?]:
2-(3-chloro-2-methyl-phenyl)imino-5-[(4-diethylaminophenyl)methylene]thiazolidin-4-one
SMILES [?]:
CCN(CC)c1ccc(cc1)C=C2C(=O)NC(=Nc3cccc(c3C)Cl)S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H22ClN3OS
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:13.1866
Area:619.815
Solvation:-2.30877
Coulombic:-36.2376
Bond Count [?]
All:29
Single:20
Double:9
Rotors:5
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:399.938
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.99
LogP (Chemaxon):6.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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