Dapoxetine hydrochloride - ≥98%(HPLC) , CAS No.129938-20-1

CAS: 129938-20-1 Cat. No.: D129639 Molecular Weight: 341.87 EC Number: 640-411-8

GRADE & PURITY ≥98%(HPLC)

Synonyms

Asulfidine | Dapoxetine (as hydrochloride) | Dapoxetine hydrochloride, >=98% (HPLC) | (1S)-N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine;hydrochloride | CCG-267940 | D03649 | LY-210448 hydrochloride;(S)-N,N-dimethyl-1-phenyl-3-(1-naphthalenylox

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Dapoxetine HCl is a short-acting novel selective serotonin reuptake inhibitor
A selective serotonin reuptake inhibitor

Specifications

Synonyms

Asulfidine | Dapoxetine (as hydrochloride) | Dapoxetine hydrochloride, >=98% (HPLC) | (1S)-N, N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine;hydrochloride | CCG-267940 | D03649 | LY-210448 hydrochloride;(S)-N, N-dimethyl-1-phenyl-3-(1-naphthalenylox

Specifications & Purity

≥98%(HPLC)

Biochemical and Physiological Mechanisms

Effective selective serotonin reuptake inhibitors (SSRIs); Used to treat premature ejaculation Dapoxetine can block the recombinant Kv4.3 voltage gated potassium channel. Confirmed as a safe therapeutic drug.

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 504754616
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754616
• Canonical Smiles: CN(C)C(CCOC1=CC=CC2=CC=CC=C21)C3=CC=CC=C3.Cl
• IUPAC Name: (1S)-N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amine;hydrochloride
• InChIKey: IHWDIQRWYNMKFM-BDQAORGHSA-N
• INCHI: 1S/C21H23NO.ClH/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21;/h3-14,20H,15-16H2,1-2H3;1H/t20-;/m0./s1
• Isomeric SMILES: CN(C)[C@@H](CCOC1=CC=CC2=CC=CC=C21)C3=CC=CC=C3.Cl
• WGK Germany: 3
• Molecular Weight: 341.87
• Reaxy-Rn: 32311059
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=32311059&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Aralkylamines Alkyl aryl ethers Benzene and substituted derivatives Trialkylamines Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Tertiary amine - Tertiary aliphatic amine - Ether - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrochloride - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

HepG2 (196354 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in DMSO (68 mg/ml at 25 °C), chloroform, methanol, water (68 mg/ml at 25 °C), and ethanol (68 mg/ml at 25 °C).
• Sensitivity: Heat Sensitive；Moisture sensitive
• Specific Rotation[α]: 125° (C=1,MeOH)
• Melt Point(°C): 181 °C
• Molecular Weight: 341.900 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 341.155 Da
• Monoisotopic Mass: 341.155 Da
• Topological Polar Surface Area: 12.500 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 337.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Yanbo Tian, Liju Tan, Huiru Li, Yu Qiao, Na Wang, Jiangtao Wang.  (2024)  Preparation of magnetic molecular imprinted polymers based on deep eutectic solvent and its application in the specific adsorption and detection of fluoxetine hydrochloride.  REACTIVE & FUNCTIONAL POLYMERS,      [PMID:] [10.1016/j.reactfunctpolym.2024.106122]