2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole

Formula:C15H12NClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole is a drug-like molecule.

MolName	2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole
MolecularFormula	C15H12NClS
Smiles	Clc1ccc(/C=C/C2Sc(cccc3)c3N2)cc1
InChI	InChI=1S/C15H12ClNS/c16-12-8-5-11(6-9-12)7-10-15-17-13-3-1-2-4-14(13)18-15/h1-10,15,17H/t15-/m0/s1
InChIK	XKWXYFQNKYFVBR-HNNXBMFYSA-N
TotalMolweight	273.786
Molweight	273.786
MonoisotopicMass	273.037896
CLogP	4.2107
CLogS	-5.016
H Acceptors	1
H Donors	1
TotalSurfaceArea	202.89
Relative PSA	0.14269
PolarSurfaceArea	37.33
Druglikeness	1.2932
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	18
NonCHAtoms	3
Electronegative Atoms	3
StereoCenters	1
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
StereoCon	racemate

Click to Load Molecule:

1 - 2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole | 2 - 2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole

Request More Details | 2-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dihydro-1,3-benzothiazole

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments