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[11C]McN-5652X structure
Fine Chemical

[11C]McN-5652X

TL;DR: [11C]McN-5652X (CAS 151121-37-8) is a chemical compound with molecular formula C19H21NS and molecular weight 294.1509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(6S,10bR)-6-(4-(111C)methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline

Also Known As: [11C]McN-5652X|(11C)-(+)-MCN-5652|(+)-mcn-5652 c-11|11C-McN(+)5652|MCN-5652 C-11, (+)-|MCN-5652, (11C)-(+)-|(11C)(+)-McN-5652|J1.853.540H|Pyrrolo(2,1-a)isoquinoline, 1,2,3,5,6,10b-hexahydro-6-(4-(methyl-11c-thio)phenyl)-, (6S,10bR)-|(6S,10bR)-6-(4-methylsulfanylphenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline|(6S)-1,2,3,5,6,10balpha-Hexahydro-6beta-[4-[(11C)methylthio]phenyl]pyrrolo[2,1-a]isoquinoline|(6S)-6beta-[4-[[(11C)Methyl]thio]phenyl]-1,2,3,5,6,10balpha-hexahydropyrrolo[2,1-a]isoquinoline|(6S,10BR)-1,2,3,5,6,10B-HEXAHYDRO-6-(4-(METHYL-11C-THIO)PHENYL)PYRROLO(2,1-A)ISOQUINOLINE|(6S,10bR)-6-[4-[(11C)Methylthio]phenyl]-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline|(6S,10bR)-6-{4-[(11C)methylsulfanyl]phenyl}-1H,2H,3H,5H,6H,10bH-pyrrolo[2,1-a]isoquinoline|05D739272C|MOLI001657|CHEMBL2114391|MOLI000230

CAS Number
151121-37-8
Molecular Formula
C19H21NS
Molecular Weight
294.1509 g/mol
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Technical Specifications

Molecular FormulaC19H21NS
Molecular Weight294.1509 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)28.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass294.1509 Da
Heavy Atoms21
Complexity349.0
SMILES[11CH3]SC1=CC=C(C=C1)[C@@H]2CN3CCC[C@@H]3C4=CC=CC=C24
InChIKeyYVKDUIAAPBKHMJ-AANZQFEOSA-N

Chemical Property Profile of [11C]McN-5652X

XLogP
4.3
TPSA (Topological Polar Surface Area)
28.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
21
Complexity
349.0
Exact Mass
294.1509
Monoisotopic Mass
294.1509
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [11C]McN-5652X

The XLogP value of 4.3 indicates that [11C]McN-5652X is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, [11C]McN-5652X exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [11C]McN-5652X has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of [11C]McN-5652X?

The CAS number of [11C]McN-5652X is 151121-37-8.

What is the molecular formula of [11C]McN-5652X?

The molecular formula of [11C]McN-5652X is C19H21NS.

What is the molecular weight of [11C]McN-5652X?

The molecular weight of [11C]McN-5652X is 294.1509 g/mol.

Where can I buy [11C]McN-5652X?

You can request a quote for [11C]McN-5652X directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [11C]McN-5652X?

Yes, CoreyChem provides custom synthesis services for [11C]McN-5652X and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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