4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate

Formula:C17H12N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate is a drug-like molecule.

MolName	4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate
MolecularFormula	C17H12N3O4
Smiles	N#Cc(cc1)ccc1OCC(N/N=C\c(cc1)ccc1C([O-])=O)=O
InChI	InChI=1S/C17H13N3O4/c18-9-12-3-7-15(8-4-12)24-11-16(21)20-19-10-13-1-5-14(6-2-13)17(22)23/h1-8,10H,11H2,(H,20,21)(H,22,23)/p-1
InChIK	XSGGFTPLXKHSST-UHFFFAOYSA-M
TotalMolweight	322.299
Molweight	322.299
MonoisotopicMass	322.082782
CLogP	0.0212
CLogS	-4.287
H Acceptors	7
H Donors	1
TotalSurfaceArea	257.74
Relative PSA	0.33712
PolarSurfaceArea	114.61
Druglikeness	-0.033575
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.75
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	4
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate | 2 - 4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate

Request More Details | 4-[(Z)-[[2-(4-cyanophenoxy)acetyl]hydrazinylidene]methyl]benzoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments