Chemical ID: 6403128

c1ccc(cc1)N=C2N(C(=O)C(=Cc3ccc4c(c3)OCO4)S2)C5CCCC5
Chemical ID:
6403128
Name [?]:
5-(benzo[1,3]dioxol-5-ylmethylene)-3-cyclopentyl-2-phenylimino-thiazolidin-4-one
SMILES [?]:
c1ccc(cc1)N=C2N(C(=O)C(=Cc3ccc4c(c3)OCO4)S2)C5CCCC5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20N2O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.7151
Area:555.658
Solvation:-3.17636
Coulombic:-42.6189
Bond Count [?]
All:32
Single:23
Double:9
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:392.472
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.25
LogP (Chemaxon):5.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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