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Resorufin benzyl ether

CAT: 0013-GTR19297453-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19297453-01Size:1 mg
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Description
Resorufin benzyl ether is a fluorogenic substrate for CYP3A4, used at ~30 μM to assess enzyme activity, inhibition, or induction in drug interaction studies. Its cleavage yields a red-fluorescent product (Ex/Em 571/585 nm), enabling sensitive in vitro screening crucial for pharmacokinetic and toxicology research.
CAS Number
87687-02-3
Purity
99.46% (May vary between batches)
Molecular Weight
303.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Benzyloxyresorufin
CAS Number87687-02-3
PubChem CID114982
IUPAC Name7-phenylmethoxyphenoxazin-3-one
Molecular FormulaC19H13NO3
Molecular Weight303.3
XLogP2.9
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity557
SMILES
C1=CC=C(C=C1)COC2=CC3=C(C=C2)N=C4C=CC(=O)C=C4O3
InChI
InChI=1S/C19H13NO3/c21-14-6-8-16-18(10-14)23-19-11-15(7-9-17(19)20-16)22-12-13-4-2-1-3-5-13/h1-11H,12H2
InChIKey
XNZRYTITWLGTJS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyloxyresorufin
CAS: 87687-02-3
CID: 114982
Formula: C19H13NO3
MW: 303.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight303.3
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass303.08954328
Monoisotopic Mass303.08954328
Topological Polar Surface Area47.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity557
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-D0146-01Resorufin benzyl ether
15020-AATResorufin benzyl ether *CAS 87687-02-3*
T22973Resorufin methyl ether
T23134Resorufin pentyl ether
258071-01Resorufin ethyl ether

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