N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

Formula:C22H24N7O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine is not a drug-like molecule.

MolName	N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
MolecularFormula	C22H24N7O3Br
Smiles	Brc(cc1)ccc1-c1ccc(/C=N\Nc2nc(N3CCOCC3)nc(N3CCOCC3)n2)o1
InChI	InChI=1S/C22H24BrN7O3/c23-17-3-1-16(2-4-17)19-6-5-18(33-19)15-24-28-20-25-21(29-7-11-31-12-8-29)27-22(26-20)30-9-13-32-14-10-30/h1-6,15H,7-14H2,(H,25,26,27,28)
InChIK	OECPQLAFYIBSDA-UHFFFAOYSA-N
TotalMolweight	514.383
Molweight	514.383
MonoisotopicMass	513.112399
CLogP	5.2646
CLogS	-5.835
H Acceptors	10
H Donors	1
TotalSurfaceArea	357.28
Relative PSA	0.27175
PolarSurfaceArea	101.14
Druglikeness	3.3847
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	10
Symmetricatoms	12
Aromatic Nitrogens	3
BasicNitrogens	3
StereoCon

Click to Load Molecule:

1 - N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine | 2 - N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

Request More Details | N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments