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IP2015

CAT: 0013-GTR19234158-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19234158-01Size:25 mg
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Description
IP2015 is a triple monoamine reuptake inhibitor that also promotes central dopamine release and peripheral nitric oxide production. This dual mechanism facilitates NO-mediated erectile tissue relaxation, making it a useful research compound for studying erectile function in rat models and neurotransmission in vitro.
CAS Number
1320346-14-2
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
O (C=1C=C2C (C=C (OC) C (=O) O2) =CC1) [C@H]3C[C@]4 (N[C@@] (C3) (CC4) [H]) [H]
Molecular Formula
C17H19NO4
Molecular Weight
301.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pudafensine
CAS Number1320346-14-2
PubChem CID53308741
IUPAC Name7-[[(1S,5R)-8-azabicyclo[3.2.1]octan-3-yl]oxy]-3-methoxychromen-2-one
Molecular FormulaC17H19NO4
Molecular Weight301.34
XLogP2.8
Topological Polar Surface Area56.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity465
SMILES
COC1=CC2=C(C=C(C=C2)OC3C[C@H]4CC[C@@H](C3)N4)OC1=O
InChI
InChI=1S/C17H19NO4/c1-20-16-6-10-2-5-13(9-15(10)22-17(16)19)21-14-7-11-3-4-12(8-14)18-11/h2,5-6,9,11-12,14,18H,3-4,7-8H2,1H3/t11-,12+,14?
InChIKey
JCRMWMMEWIZRMN-ONXXMXGDSA-N
Chemical Structure
2D Structure
2D structure of Pudafensine
CAS: 1320346-14-2
CID: 53308741
Formula: C17H19NO4
MW: 301.34
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight301.34
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass301.13140809
Monoisotopic Mass301.13140809
Topological Polar Surface Area56.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity465
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-162511IP2015

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