(Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine

Formula:C11H9N4Br Mutagenic:none Tumorigenic:none Reproductive Effective:high (Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine is a drug-like molecule.

MolName	(Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine
MolecularFormula	C11H9N4Br
Smiles	Br/C(/c1ccccc1)=C\C=N/n1cnnc1
InChI	InChI=1S/C11H9BrN4/c12-11(10-4-2-1-3-5-10)6-7-15-16-8-13-14-9-16/h1-9H
InChIK	AIMGJHFDPDDTKI-UHFFFAOYSA-N
TotalMolweight	277.124
Molweight	277.124
MonoisotopicMass	276.001057
CLogP	1.6563
CLogS	-3.893
H Acceptors	4
TotalSurfaceArea	187.84
Relative PSA	0.21465
PolarSurfaceArea	43.07
Druglikeness	-1.4329
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.6875
Fragments	1
Non HAtoms	16
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	4
Aromatic Nitrogens	3
StereoCon

Click to Load Molecule:

1 - (Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine | 2 - (Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine

Request More Details | (Z,Z)-3-bromo-3-phenyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments