5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid

Formula:C16H11N2O4ClF4 Mutagenic:none Tumorigenic:high Reproductive Effective:none 5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid is not a drug-like molecule.

MolName	5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid
MolecularFormula	C16H11N2O4ClF4
Smiles	OC(c(cc(cc1)N/N=C\c(ccc(OC(F)F)c2)c2OC(F)F)c1Cl)=O
InChI	InChI=1S/C16H11ClF4N2O4/c17-12-4-2-9(5-11(12)14(24)25)23-22-7-8-1-3-10(26-15(18)19)6-13(8)27-16(20)21/h1-7,15-16,23H,(H,24,25)
InChIK	JDKIOFGCUSMFIS-UHFFFAOYSA-N
TotalMolweight	406.718
Molweight	406.718
MonoisotopicMass	406.034347
CLogP	5.2708
CLogS	-5.142
H Acceptors	6
H Donors	2
TotalSurfaceArea	279.16
Relative PSA	0.24756
PolarSurfaceArea	80.15
Druglikeness	-0.88877
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid | 2 - 5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid

Request More Details | 5-[(2Z)-2-[[2,4-bis(difluoromethoxy)phenyl]methylidene]hydrazinyl]-2-chlorobenzoic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments