6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Formula:C25H15NO4Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:high 6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one is not a drug-like molecule.

MolName	6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one
MolecularFormula	C25H15NO4Br2
Smiles	O=C(/C=C/c(cc1OCOc1c1)c1Br)C1=C(c2ccccc2)c(cc(cc2)Br)c2NC1=O
InChI	InChI=1S/C25H15Br2NO4/c26-16-7-8-19-17(11-16)23(14-4-2-1-3-5-14)24(25(30)28-19)20(29)9-6-15-10-21-22(12-18(15)27)32-13-31-21/h1-12H,13H2,(H,28,30)
InChIK	BPTGZQWUUXAFGU-UHFFFAOYSA-N
TotalMolweight	553.205
Molweight	553.205
MonoisotopicMass	550.936781
CLogP	5.6216
CLogS	-7.582
H Acceptors	5
H Donors	1
TotalSurfaceArea	333.18
Relative PSA	0.1727
PolarSurfaceArea	64.63
Druglikeness	1.8036
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.4375
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - 6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one | 2 - 6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Request More Details | 6-bromo-3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments