(Z)-N-cyclohexyl-4-(furan-2-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine

Formula:C19H20N4OS Mutagenic:low Tumorigenic:none Reproductive Effective:none (Z)-N-cyclohexyl-4-(furan-2-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine is a drug-like molecule.

MolName(Z)-N-cyclohexyl-4-(furan-2-yl)-3-[(Z)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine
MolecularFormulaC19H20N4OS
SmilesC(CC1)CCC1/N=C1\SC=C(c2ccco2)N1/N=C\c1ncccc1
InChIInChI=1S/C19H20N4OS/c1-2-7-15(8-3-1)22-19-23(21-13-16-9-4-5-11-20-16)17(14-25-19)18-10-6-12-24-18/h4-6,9-15H,1-3,7-8H2
InChIKCYWSBERFUNYQQW-UHFFFAOYSA-N
TotalMolweight352.461
Molweight352.461
MonoisotopicMass352.135781
CLogP3.8475
CLogS-4.957
H Acceptors5
TotalSurfaceArea276
Relative PSA0.25051
PolarSurfaceArea79.29
Druglikeness-2.7114
Mutageniclow
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.52
Fragments1
Non HAtoms25
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms7
Symmetricatoms2
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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