(4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione

Formula:C23H15NO3Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:high (4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione is a drug-like molecule.

MolName	(4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione
MolecularFormula	C23H15NO3Cl2
Smiles	O=C(/C(/c(cccc1)c1C1=O)=C\c2ccccc2)N1OCc(ccc(Cl)c1)c1Cl
InChI	InChI=1S/C23H15Cl2NO3/c24-17-11-10-16(21(25)13-17)14-29-26-22(27)19-9-5-4-8-18(19)20(23(26)28)12-15-6-2-1-3-7-15/h1-13H,14H2
InChIK	ILAMOZJQLGGPPM-UHFFFAOYSA-N
TotalMolweight	424.282
Molweight	424.282
MonoisotopicMass	423.042898
CLogP	4.3995
CLogS	-5.891
H Acceptors	4
TotalSurfaceArea	304.39
Relative PSA	0.13019
PolarSurfaceArea	46.61
Druglikeness	2.2305
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
StereoCon

Click to Load Molecule:

1 - (4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione | 2 - (4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione

Request More Details | (4Z)-4-benzylidene-2-[(2,4-dichlorophenyl)methoxy]isoquinoline-1,3-dione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments