Sildenafil Mesylate - ≥98% , CAS No.1308285-21-3

CAS: 1308285-21-3 Cat. No.: S413169 Formule: C₂₂H₃₀N₆O₄S.xCH₄O₃S Poids moléculaire: 474.58(free base) PubChem CID: 135425271

GRADE & PURITY ≥98%

Synonyms

7H-​Pyrazolo[4,​3-​d]​pyrimidin-​7-​one,5-​[2-​ethoxy-​5-​[(4-​methyl-​1-​piperazinyl)​sulfonyl]​phenyl]​-​1,​6-​dihydro-​1-​methyl-​3-​propyl-​,methanesulfonate (1:?)

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Vue d’ensemble

Information

Sildenafil Mesylate is a mesylate form of Sildenafil, an inhibitor ofPhosphodiesterase 5.

Targets

PDE5

In vivo

Chronic sildenafil treatment increases the detumescence phase in young and aged rats (p<0.05), although aged rats show a greater increase than young rats. Baseline cavernous PDE5 expression and activity are greater in aged vs young rats (p<0.05). After chronic sildenafil treatment cavernous PDE5 expression is increased in young (p<0.05) but not in aged rats. Chronic and acute sildenafil treatment similarly inhibits PDE5 activity in the penis of young and aged rats (p<0.05), coincident with its free plasma concentrations equivalent to clinically therapeutic ranges.

Specifications

Synonymes

7H-​Pyrazolo[4,​3-​d]​pyrimidin-​7-​one,5-​[2-​ethoxy-​5-​[(4-​methyl-​1-​piperazinyl)​sulfonyl]​phenyl]​-​1,​6-​dihydro-​1-​methyl-​3-​propyl-​,methanesulfonate (1:?)

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

Sildenafil Mesylate is a mesylate form of Sildenafil, an inhibitor of Phosphodiesterase 5.

Conditions de stockage de stockage

Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Propriétés du produit

ALogP

1.833

Nombre de HBD

1

Liaison rotative

7

Noms et identifiants

Pubchem Sid

504773303

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504773303

Sourires canoniques

CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C.CS(=O)(=O)O

IUPAC Name

5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one;methanesulfonic acid

InChIKey

WEWNUXJEVSROFW-UHFFFAOYSA-N

INCHI

1S/C22H30N6O4S.CH4O3S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28;1-5(2,3)4/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29);1H3,(H,2,3,4)

PubChem CID

135425271

Poids moléculaire

474.58(free base)

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzenesulfonamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzenesulfonamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonamides
• Alternative Parents: Benzenesulfonyl compounds Pyrazolopyrimidines Phenoxy compounds Phenol ethers Alkyl aryl ethers N-methylpiperazines Pyrimidones Organosulfonamides Alkanesulfonic acids Vinylogous amides Heteroaromatic compounds Methanesulfonates Organosulfonic acids Pyrazoles Sulfonyls Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Benzenesulfonamide - Benzenesulfonyl group - Pyrazolopyrimidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrimidone - N-alkylpiperazine - N-methylpiperazine - 1,4-diazinane - Piperazine - Pyrimidine - Organosulfonic acid amide - Azole - Methanesulfonate - Heteroaromatic compound - Pyrazole - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Alkanesulfonic acid - Organosulfonic acid - Sulfonyl - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
• 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

Propriétés chimiques et physiques

• Solubilité: Solubility (25°C) In vitro DMSO: 100 mg/mL Water: 100 mg/mL Ethanol: 4 mg/mL
• DMSO (mg/mL) Solubilité maximale: 100
• DMSO (mM) Solubilité maximale: 211
• Eau (mg/mL) Solubilité maximale: 100
• Poids moléculaire: 570.700 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 7
• Exact Mass: 570.193 Da
• Monoisotopic Mass: 570.193 Da
• Topological Polar Surface Area: 180.000 Ų
• Heavy Atom Count: 38
• Formal Charge: 0
• Complexity: 931.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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