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Isocarfentanil structure
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Isocarfentanil

TL;DR: Isocarfentanil (CAS 156724-56-0) is a chemical compound with molecular formula C24H30N2O3 and molecular weight 394.22565 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 1-(2-phenylethyl)-4-(N-propanoylanilino)piperidine-3-carboxylate

Also Known As: Isocarfentanil, Methyl 1-phenethyl-4-(phenyl-propanoyl-amino)piperidine-3-carboxylate

CAS Number
156724-56-0
Molecular Formula
C24H30N2O3
Molecular Weight
394.22565 g/mol
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Technical Specifications

Molecular FormulaC24H30N2O3
Molecular Weight394.22565 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)49.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds8
Exact Mass394.22565 Da
Heavy Atoms29
Complexity526.0
SMILESCCC(=O)N(C1CCN(CC1C(=O)OC)CCC2=CC=CC=C2)C3=CC=CC=C3
InChIKeyICJRJLQXLMKEML-UHFFFAOYSA-N

Chemical Property Profile of Isocarfentanil

XLogP
3.6
TPSA (Topological Polar Surface Area)
49.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
8
Heavy Atoms
29
Complexity
526.0
Exact Mass
394.22565
Monoisotopic Mass
394.22565
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 Isocarfentanil

The XLogP value of 3.6 indicates that Isocarfentanil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, Isocarfentanil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isocarfentanil has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Isocarfentanil?

The CAS number of Isocarfentanil is 156724-56-0.

What is the molecular formula of Isocarfentanil?

The molecular formula of Isocarfentanil is C24H30N2O3.

What is the molecular weight of Isocarfentanil?

The molecular weight of Isocarfentanil is 394.22565 g/mol.

Where can I buy Isocarfentanil?

You can request a quote for Isocarfentanil directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Isocarfentanil?

Yes, CoreyChem provides custom synthesis services for Isocarfentanil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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