Chemical ID: 4544932

CCN1C(=O)C(=Cc2ccc(cc2)C(=O)OC)SC1=Nc3ccc(cc3)OC
Chemical ID:
4544932
Name [?]:
methyl 4-[[3-ethyl-2-(4-methoxyphenyl)imino-4-oxo-thiazolidin-5-ylidene]methyl]benzoate
SMILES [?]:
CCN1C(=O)C(=Cc2ccc(cc2)C(=O)OC)SC1=Nc3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H20N2O4S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.8897
Area:598.801
Solvation:-4.08032
Coulombic:-51.9358
Bond Count [?]
All:30
Single:20
Double:10
Rotors:6
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:396.461
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.51
LogP (Chemaxon):4.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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