3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one

Formula:C18H11O3Br Mutagenic:none Tumorigenic:none Reproductive Effective:low 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one is a drug-like molecule.

MolName	3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one
MolecularFormula	C18H11O3Br
Smiles	O=C(/C=C/c(cc1)ccc1Br)C1=Cc(cccc2)c2OC1=O
InChI	InChI=1S/C18H11BrO3/c19-14-8-5-12(6-9-14)7-10-16(20)15-11-13-3-1-2-4-17(13)22-18(15)21/h1-11H
InChIK	PAOWCYOCGZAQIT-UHFFFAOYSA-N
TotalMolweight	355.186
Molweight	355.186
MonoisotopicMass	353.989156
CLogP	3.8372
CLogS	-4.79
H Acceptors	3
TotalSurfaceArea	234.86
Relative PSA	0.15362
PolarSurfaceArea	43.37
Druglikeness	-3.0284
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

Click to Load Molecule:

1 - 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one | 2 - 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one

Request More Details | 3-[(E)-3-(4-bromophenyl)prop-2-enoyl]chromen-2-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments