2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid

Formula:C17H14N4O2S Mutagenic:none Tumorigenic:high Reproductive Effective:high 2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid is a drug-like molecule.

MolName	2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid
MolecularFormula	C17H14N4O2S
Smiles	OC(Cc1c(-c2ccccc2)nc(N/N=C\c2ccncc2)s1)=O
InChI	InChI=1S/C17H14N4O2S/c22-15(23)10-14-16(13-4-2-1-3-5-13)20-17(24-14)21-19-11-12-6-8-18-9-7-12/h1-9,11H,10H2,(H,20,21)(H,22,23)
InChIK	FVDQXHCLRPAMTR-UHFFFAOYSA-N
TotalMolweight	338.39
Molweight	338.39
MonoisotopicMass	338.083746
CLogP	4.6105
CLogS	-3.953
H Acceptors	6
H Donors	2
TotalSurfaceArea	260.32
Relative PSA	0.35114
PolarSurfaceArea	115.71
Druglikeness	3.7426
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid | 2 - 2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid

Request More Details | 2-[4-phenyl-2-[(2Z)-2-(pyridin-4-ylmethylidene)hydrazinyl]-1,3-thiazol-5-yl]acetic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments