N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Formula:C22H28N7Cl Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
MolecularFormula	C22H28N7Cl
Smiles	Clc1c(/C=C/C=N\Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)cccc1
InChI	InChI=1S/C22H28ClN7/c23-19-12-4-3-10-18(19)11-9-13-24-28-20-25-21(29-14-5-1-6-15-29)27-22(26-20)30-16-7-2-8-17-30/h3-4,9-13H,1-2,5-8,14-17H2,(H,25,26,27,28)
InChIK	WHBPKKYZXJNKAR-UHFFFAOYSA-N
TotalMolweight	425.966
Molweight	425.966
MonoisotopicMass	425.20947
CLogP	6.5528
CLogS	-6.347
H Acceptors	7
H Donors	1
TotalSurfaceArea	338.64
Relative PSA	0.18598
PolarSurfaceArea	69.54
Druglikeness	2.7585
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	10
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

Click to Load Molecule:

1 - N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine | 2 - N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Request More Details | N-[(Z)-[(E)-3-(2-chlorophenyl)prop-2-enylidene]amino]-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments