N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide

Formula:C34H32N4O Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide
MolecularFormula	C34H32N4O
Smiles	O=C(c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1)N/N=C\c1c(cccc2)c2cc2ccccc12
InChI	InChI=1S/C34H32N4O/c39-34(36-35-23-33-31-12-6-4-10-29(31)22-30-11-5-7-13-32(30)33)28-16-14-27(15-17-28)25-38-20-18-37(19-21-38)24-26-8-2-1-3-9-26/h1-17,22-23H,18-21,24-25H2,(H,36,39)
InChIK	YDTCXEZHGNLLME-UHFFFAOYSA-N
TotalMolweight	512.655
Molweight	512.655
MonoisotopicMass	512.257611
CLogP	6.7098
CLogS	-7.339
H Acceptors	5
H Donors	1
TotalSurfaceArea	405.61
Relative PSA	0.10628
PolarSurfaceArea	47.94
Druglikeness	9.2701
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.58974
Fragments	1
Non HAtoms	39
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	7
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	8
Symmetricatoms	12
Amines	2
AlkylAmines	2
BasicNitrogens	2
StereoCon

Click to Load Molecule:

1 - N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide | 2 - N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide

Request More Details | N-[(Z)-anthracen-9-ylmethylideneamino]-4-[(4-benzylpiperazin-1-yl)methyl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments