N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide

Formula:C31H24N2O2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C31H24N2O2
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1c(cccc2)c2cc2ccccc12)NCc1ccccc1
InChI	InChI=1S/C31H24N2O2/c34-30(23-13-5-2-6-14-23)33-29(31(35)32-21-22-11-3-1-4-12-22)20-28-26-17-9-7-15-24(26)19-25-16-8-10-18-27(25)28/h1-20H,21H2,(H,32,35)(H,33,34)
InChIK	QUWTWRSKWMVHMU-UHFFFAOYSA-N
TotalMolweight	456.544
Molweight	456.544
MonoisotopicMass	456.183778
CLogP	6.522
CLogS	-7.901
H Acceptors	4
H Donors	2
TotalSurfaceArea	358.87
Relative PSA	0.13654
PolarSurfaceArea	58.2
Druglikeness	3.4137
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.4
Fragments	1
Non HAtoms	35
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	1
Symmetricatoms	10
Amides	2
StereoCon

Click to Load Molecule:

1 - N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide

Request More Details | N-[(Z)-1-anthracen-9-yl-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments