(5Z)-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-3-(furan-2-ylmethyl)-2-phenylimino-1,3-thiazolidin-4-one

Formula:C21H14N2O3Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-3-(furan-2-ylmethyl)-2-phenylimino-1,3-thiazolidin-4-one is a drug-like molecule.

MolName(5Z)-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-3-(furan-2-ylmethyl)-2-phenylimino-1,3-thiazolidin-4-one
MolecularFormulaC21H14N2O3Cl2S
SmilesOc(c(Cl)cc(/C=C(/C(N1Cc2ccco2)=O)\S/C1=N\c1ccccc1)c1)c1Cl
InChIInChI=1S/C21H14Cl2N2O3S/c22-16-9-13(10-17(23)19(16)26)11-18-20(27)25(12-15-7-4-8-28-15)21(29-18)24-14-5-2-1-3-6-14/h1-11,26H,12H2
InChIKVPMSMQTXADUFCU-UHFFFAOYSA-N
TotalMolweight445.325
Molweight445.325
MonoisotopicMass444.010217
CLogP4.6559
CLogS-6.186
H Acceptors5
H Donors1
TotalSurfaceArea313.14
Relative PSA0.23248
PolarSurfaceArea91.34
Druglikeness4.285
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.48276
Fragments1
Non HAtoms29
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms3
Symmetricatoms5
Amides1
StereoCon

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