Chemical ID: 4412120

COc1ccccc1OCCCOc2ccc(cc2)C=C3C(=O)N(C(=S)S3)c4ccccc4F
Chemical ID:
4412120
Name [?]:
3-(2-fluorophenyl)-5-[[4-[3-(2-methoxyphenoxy)propoxy]phenyl]methylene]-2-thioxo-thiazolidin-4-one
SMILES [?]:
COc1ccccc1OCCCOc2ccc(cc2)C=C3C(=O)N(C(=S)S3)c4ccccc4F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H22FNO4S2
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:10.5992
Area:731.111
Solvation:-7.67855
Coulombic:-45.78
Bond Count [?]
All:37
Single:25
Double:12
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:495.588
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.2
LogP (Chemaxon):5.79

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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