Chemical ID: 4105826

COc1cc(cc(c1OC)OC)C=C2C(=O)N=C(S2)Nc3ccc(cc3)Cl
Chemical ID:
4105826
Name [?]:
2-(4-chlorophenyl)amino-5-[(3,4,5-trimethoxyphenyl)methylene]thiazol-4-one
SMILES [?]:
COc1cc(cc(c1OC)OC)C=C2C(=O)N=C(S2)Nc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H17ClN2O4S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.69621
Area:601.651
Solvation:-6.34507
Coulombic:-50.9059
Bond Count [?]
All:29
Single:20
Double:9
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:404.868
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.32
LogP (Chemaxon):3.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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