4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile

Formula:C24H12N4O4Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile is a drug-like molecule.

MolName	4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile
MolecularFormula	C24H12N4O4Cl2
Smiles	N#Cc(cc1)cc([N+]([O-])=O)c1/C(/Cl)=C/c1ccc(/C=C(/c(ccc(C#N)c2)c2[N+]([O-])=O)\Cl)cc1
InChI	InChI=1S/C24H12Cl2N4O4/c25-21(19-7-5-17(13-27)11-23(19)29(31)32)9-15-1-2-16(4-3-15)10-22(26)20-8-6-18(14-28)12-24(20)30(33)34/h1-12H
InChIK	MGZQRVWLAREXGQ-UHFFFAOYSA-N
TotalMolweight	491.289
Molweight	491.289
MonoisotopicMass	490.02356
CLogP	4.459
CLogS	-6.652
H Acceptors	8
TotalSurfaceArea	363.8
Relative PSA	0.24178
PolarSurfaceArea	139.22
Druglikeness	-10.18
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	allyl/benzyl chloride; aromatic nitro
Shape Index	0.58824
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	18
AcidicOxygens	2
StereoCon

Click to Load Molecule:

1 - 4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile | 2 - 4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile

Request More Details | 4-[(Z)-1-chloro-2-[4-[(Z)-2-chloro-2-(4-cyano-2-nitrophenyl)ethenyl]phenyl]ethenyl]-3-nitrobenzonitrile

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments