N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine

Formula:C25H18N4OBr2 Mutagenic:low Tumorigenic:high Reproductive Effective:none N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine
MolecularFormula	C25H18N4OBr2
Smiles	Brc1cc(/C=N\Nc2nc(cccc3)c3[nH]2)cc(Br)c1OCc1cccc2ccccc12
InChI	InChI=1S/C25H18Br2N4O/c26-20-12-16(14-28-31-25-29-22-10-3-4-11-23(22)30-25)13-21(27)24(20)32-15-18-8-5-7-17-6-1-2-9-19(17)18/h1-14H,15H2,(H2,29,30,31)
InChIK	LFMZCEDJUWGYOG-UHFFFAOYSA-N
TotalMolweight	550.253
Molweight	550.253
MonoisotopicMass	547.984733
CLogP	8.8029
CLogS	-8.246
H Acceptors	5
H Donors	2
TotalSurfaceArea	347.55
Relative PSA	0.16668
PolarSurfaceArea	62.3
Druglikeness	0.81363
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Symmetricatoms	3
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine | 2 - N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine

Request More Details | N-[(Z)-[3,5-dibromo-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-1H-benzimidazol-2-amine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments