2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine

Formula:C21H21N7Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine is not a drug-like molecule.

MolName	2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
MolecularFormula	C21H21N7Cl2
Smiles	Clc1cc(Cl)c(/C=N\Nc2nc(N3CCCCC3)nc(Nc3ccccc3)n2)cc1
InChI	InChI=1S/C21H21Cl2N7/c22-16-10-9-15(18(23)13-16)14-24-29-20-26-19(25-17-7-3-1-4-8-17)27-21(28-20)30-11-5-2-6-12-30/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H2,25,26,27,28,29)
InChIK	DBRLQGAIQIOXTM-UHFFFAOYSA-N
TotalMolweight	442.353
Molweight	442.353
MonoisotopicMass	441.123547
CLogP	7.8379
CLogS	-7.377
H Acceptors	7
H Donors	2
TotalSurfaceArea	333.18
Relative PSA	0.21277
PolarSurfaceArea	78.33
Druglikeness	2.9448
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

Click to Load Molecule:

1 - 2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine | 2 - 2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine

Request More Details | 2-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-4-N-phenyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments