(5E)-2-phenyl-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one

Formula:C14H9NOS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-2-phenyl-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one is a drug-like molecule.

MolName(5E)-2-phenyl-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one
MolecularFormulaC14H9NOS2
SmilesO=C1N=C(c2ccccc2)S/C1=C/c1cccs1
InChIInChI=1S/C14H9NOS2/c16-13-12(9-11-7-4-8-17-11)18-14(15-13)10-5-2-1-3-6-10/h1-9H
InChIKNWASVBKZJPXEAH-UHFFFAOYSA-N
TotalMolweight271.363
Molweight271.363
MonoisotopicMass271.012554
CLogP3.8669
CLogS-4.892
H Acceptors2
TotalSurfaceArea198.38
Relative PSA0.31455
PolarSurfaceArea82.97
Druglikeness2.8512
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61111
Fragments1
Non HAtoms18
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Symmetricatoms2
StereoCon

Request More Details | (5E)-2-phenyl-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4-one


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments