Chemical ID: 4544942

CC(C)CN1C(=O)C(=Cc2ccc(o2)c3cc(ccc3Cl)Cl)SC1=Nc4ccc(cc4)OC
Chemical ID:
4544942
Name [?]:
5-[[5-(2,5-dichlorophenyl)-2-furyl]methylene]-3-isobutyl-2-(4-methoxyphenyl)imino-thiazolidin-4-one
SMILES [?]:
CC(C)CN1C(=O)C(=Cc2ccc(o2)c3cc(ccc3Cl)Cl)SC1=Nc4ccc(cc4)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H22Cl2N2O3S
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:12.279
Area:678.327
Solvation:-4.67923
Coulombic:-38.6944
Bond Count [?]
All:36
Single:25
Double:11
Rotors:6
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:501.425
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.12
LogP (Chemaxon):6.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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