2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol

Formula:C16H15N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol is a drug-like molecule.

MolName	2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol
MolecularFormula	C16H15N3O3S
Smiles	OCCN(C(c1c2cccc1)=NS2(=O)=O)/N=C\c1ccccc1
InChI	InChI=1S/C16H15N3O3S/c20-11-10-19(17-12-13-6-2-1-3-7-13)16-14-8-4-5-9-15(14)23(21,22)18-16/h1-9,12,20H,10-11H2
InChIK	DAAZAPCUEHVOIL-UHFFFAOYSA-N
TotalMolweight	329.379
Molweight	329.379
MonoisotopicMass	329.083412
CLogP	2.3561
CLogS	-3.015
H Acceptors	6
H Donors	1
TotalSurfaceArea	240
Relative PSA	0.28438
PolarSurfaceArea	90.71
Druglikeness	4.4102
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.52174
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	3
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - 2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol | 2 - 2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol

Request More Details | 2-[[(Z)-benzylideneamino]-(1,1-dioxo-1,2-benzothiazol-3-yl)amino]ethanol

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments