Products for Research Use Only

Resorufin pentyl ether

CAT: 0804-HY-D0147-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-D0147-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Resorufin pentyl ether (Pentoxyresorufin) is a Resazurin analogue. Resorufin pentyl ether can function as a substrate probe to characterize and differentiate between a variety of inducers of cytochromes P-450. Resorufin pentyl ether has bactericidal activity against N. gonorrhoeae[1][2].
CAS Number
87687-03-4
Product Name Alternative
Pentoxyresorufin
UNSPSC
12171500
Hazard Statement
H315, H319, H335
Target
Bacterial
Type
Dye Reagents
Related Pathways
Anti-infection
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/resorufin-pentyl-ether.html
Purity
98.16
Solubility
DMF : 5 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
O=C1C=CC2=NC3=C(C=C(OCCCCC)C=C3)OC2=C1
Molecular Formula
C17H17NO3
Molecular Weight
283.32
Precautions
H315, H319, H335
References & Citations
[2]M D Burke, et al. Ethoxy-, pentoxy- and benzyloxyphenoxazones and homologues: a series of substrates to distinguish between different induced cytochromes P-450. Biochem Pharmacol. 1985 Sep 15;34 (18) :3337-45.|[1]Deanna M. Schmitt, et al. Antibacterial activity of resazurin-based compounds against Neisseria gonorrhoeae in vitro and in vivo. Int J Antimicrob Agents. 2016 Oct; 48 (4) : 367–372.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Dye Reagents
Clinical Information
No Development Reported

Chemical Information

Pentoxyresorufin
CAS Number87687-03-4
PubChem CID107683
IUPAC Name7-pentoxyphenoxazin-3-one
Molecular FormulaC17H17NO3
Molecular Weight283.32
XLogP3.2
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity492
SMILES
CCCCCOC1=CC2=C(C=C1)N=C3C=CC(=O)C=C3O2
InChI
InChI=1S/C17H17NO3/c1-2-3-4-9-20-13-6-8-15-17(11-13)21-16-10-12(19)5-7-14(16)18-15/h5-8,10-11H,2-4,9H2,1H3
InChIKey
ZPSOKQFFOYYPKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pentoxyresorufin
CAS: 87687-03-4
CID: 107683
Formula: C17H17NO3
MW: 283.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight283.32
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass283.12084340
Monoisotopic Mass283.12084340
Topological Polar Surface Area47.9 Ų
Heavy Atom Count21
Formal Charge0
Complexity492
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