Chemical ID: 4285634

CCc1nnc(s1)N=C2N(C(=O)C(=Cc3ccc(cc3)N(C)C)S2)CC=C
Chemical ID:
4285634
Name [?]:
3-allyl-5-[(4-dimethylaminophenyl)methylene]-2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]thiazolidin-4-one
SMILES [?]:
CCc1nnc(s1)N=C2N(C(=O)C(=Cc3ccc(cc3)N(C)C)S2)CC=C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H21N5OS2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:12.4805
Area:601.783
Solvation:-2.56407
Coulombic:-37.4194
Bond Count [?]
All:29
Single:20
Double:9
Rotors:6
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:399.535
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.82
LogP (Chemaxon):4.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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