[3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate

Formula:C29H19N3O6Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName	[3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormula	C29H19N3O6Cl2
Smiles	O=C(C(N/N=C\c(ccc(OC(c1ccccc1)=O)c1)c1OC(c1ccccc1)=O)=O)Nc(cc1)cc(Cl)c1Cl
InChI	InChI=1S/C29H19Cl2N3O6/c30-23-14-12-21(15-24(23)31)33-26(35)27(36)34-32-17-20-11-13-22(39-28(37)18-7-3-1-4-8-18)16-25(20)40-29(38)19-9-5-2-6-10-19/h1-17H,(H,33,35)(H,34,36)
InChIK	QAWQTCNANPNGEF-UHFFFAOYSA-N
TotalMolweight	576.391
Molweight	576.391
MonoisotopicMass	575.065091
CLogP	6.2169
CLogS	-7.937
H Acceptors	9
H Donors	2
TotalSurfaceArea	422.06
Relative PSA	0.25255
PolarSurfaceArea	123.16
Druglikeness	3.4163
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.525
Fragments	1
Non HAtoms	40
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	10
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

Click to Load Molecule:

1 - [3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate | 2 - [3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate

Request More Details | [3-benzoyloxy-4-[(Z)-[[2-(3,4-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] benzoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments