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SR 44699 A structure
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SR 44699 A

TL;DR: SR 44699 A (CAS 119585-21-6) is a chemical compound with molecular formula C24H27ClINO2 and molecular weight 523.0775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[5-(dimethylamino)-2-naphthalen-1-ylpentyl] 4-iodobenzoate;hydrochloride

Also Known As: SR 44699 A, 5-(Dimethylamino)-2-(1-naphthalenyl)pentyl 4-iodobenzoate hydrochloride, Benzoic acid, 4-iodo-, 5-(dimethylamino)-2-(1-naphthalenyl)pentyl ester, hydrochloride, 5-(Dimethylamino)-2-(naphthalen-1-yl)pentyl 4-iodobenzoate--hydrogen chloride (1/1), [5-(dimethylamino)-2-naphthalen-1-ylpentyl] 4-iodobenzoate hydrochloride

CAS Number
119585-21-6
Molecular Formula
C24H27ClINO2
Molecular Weight
523.0775 g/mol
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Technical Specifications

Molecular FormulaC24H27ClINO2
Molecular Weight523.0775 g/mol
XLogP6.1486
Topological Polar Surface Area (TPSA)29.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds9
Exact Mass523.0775 Da
Heavy Atoms29
Complexity475.0
SMILESCN(C)CCCC(COC(=O)C1=CC=C(C=C1)I)C2=CC=CC3=CC=CC=C32.Cl
InChIKeyDVQBWNPXYAGTML-UHFFFAOYSA-N

Chemical Property Profile of SR 44699 A

XLogP
6.1486
TPSA (Topological Polar Surface Area)
29.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
9
Heavy Atoms
29
Complexity
475.0
Exact Mass
523.0775
Monoisotopic Mass
523.0775
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 SR 44699 A

The XLogP value of 6.1486 indicates that SR 44699 A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, SR 44699 A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SR 44699 A has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of SR 44699 A?

The CAS number of SR 44699 A is 119585-21-6.

What is the molecular formula of SR 44699 A?

The molecular formula of SR 44699 A is C24H27ClINO2.

What is the molecular weight of SR 44699 A?

The molecular weight of SR 44699 A is 523.0775 g/mol.

Where can I buy SR 44699 A?

You can request a quote for SR 44699 A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for SR 44699 A?

Yes, CoreyChem provides custom synthesis services for SR 44699 A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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