[4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

Formula:C21H16N3O4IS Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate
MolecularFormula	C21H16N3O4IS
Smiles	O=C(CNC(c(cccc1)c1I)=O)N/N=C\c(cc1)ccc1OC(c1cccs1)=O
InChI	InChI=1S/C21H16IN3O4S/c22-17-5-2-1-4-16(17)20(27)23-13-19(26)25-24-12-14-7-9-15(10-8-14)29-21(28)18-6-3-11-30-18/h1-12H,13H2,(H,23,27)(H,25,26)
InChIK	LQHAQRSYKZMJDZ-UHFFFAOYSA-N
TotalMolweight	533.341
Molweight	533.341
MonoisotopicMass	532.990625
CLogP	4.0195
CLogS	-5.984
H Acceptors	7
H Donors	2
TotalSurfaceArea	339.69
Relative PSA	0.3059
PolarSurfaceArea	125.1
Druglikeness	7.2859
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - [4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate | 2 - [4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

Request More Details | [4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments