2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine

Formula:C29H22N7OBrCl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine is not a drug-like molecule.

MolName	2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine
MolecularFormula	C29H22N7OBrCl2
Smiles	Clc1cc(Cl)c(COc(cc2)c(/C=N\Nc3nc(Nc4ccccc4)nc(Nc4ccccc4)n3)cc2Br)cc1
InChI	InChI=1S/C29H22BrCl2N7O/c30-21-12-14-26(40-18-19-11-13-22(31)16-25(19)32)20(15-21)17-33-39-29-37-27(34-23-7-3-1-4-8-23)36-28(38-29)35-24-9-5-2-6-10-24/h1-17H,18H2,(H3,34,35,36,37,38,39)
InChIK	QPBSHGWNSSSRHW-UHFFFAOYSA-N
TotalMolweight	635.352
Molweight	635.352
MonoisotopicMass	633.044623
CLogP	10.609
CLogS	-10.138
H Acceptors	8
H Donors	3
TotalSurfaceArea	440.95
Relative PSA	0.20138
PolarSurfaceArea	96.35
Druglikeness	0.070985
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.5
Fragments	1
Non HAtoms	40
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	10
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	30
Sp3Atoms	2
Symmetricatoms	11
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

Click to Load Molecule:

1 - 2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine | 2 - 2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine

Request More Details | 2-N-[(Z)-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-4-N,6-N-diphenyl-1,3,5-triazine-2,4,6-triamine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments