Chemical ID: 4843480

COc1ccc(cc1)N=C2N(C(=O)C(=Cc3ccc4c(c3)OCO4)S2)C5CCCCC5
Chemical ID:
4843480
Name [?]:
5-(benzo[1,3]dioxol-5-ylmethylene)-3-cyclohexyl-2-(4-methoxyphenyl)imino-thiazolidin-4-one
SMILES [?]:
COc1ccc(cc1)N=C2N(C(=O)C(=Cc3ccc4c(c3)OCO4)S2)C5CCCCC5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H24N2O4S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:10.4236
Area:597.597
Solvation:-4.51631
Coulombic:-48.901
Bond Count [?]
All:35
Single:26
Double:9
Rotors:4
Chiral:2
Rigid Segments:5
Chemical Properties
Molecular Weight:436.524
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.73
LogP (Chemaxon):5.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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