Chemical ID: 5541495

CC(C)COc1ccc(cc1)C=C2C(=O)N(C(=Nc3ccc(cc3)C(=O)OC)S2)C4CCCCC4
Chemical ID:
5541495
Name [?]:
methyl 4-[3-cyclohexyl-5-[(4-isobutoxyphenyl)methylene]-4-oxo-thiazolidin-2-ylidene]aminobenzoate
SMILES [?]:
CC(C)COc1ccc(cc1)C=C2C(=O)N(C(=Nc3ccc(cc3)C(=O)OC)S2)C4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H32N2O4S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:13.8916
Area:707.941
Solvation:-3.80696
Coulombic:-53.9927
Bond Count [?]
All:38
Single:28
Double:10
Rotors:8
Chiral:2
Rigid Segments:8
Chemical Properties
Molecular Weight:492.631
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:5.99
LogP (Chemaxon):6.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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