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ML 23 structure
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ML 23

TL;DR: ML 23 (CAS 115007-18-6) is a chemical compound with molecular formula C17H16N4O5 and molecular weight 356.11206 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ML-23

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,4-dinitroaniline

Also Known As: ML 23, N-(2,4-Dinitrophenyl)-5-methoxytryptamine, 2,4-Dnp-MT, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2,4-dinitroaniline, N-(3,5-Dinitrophenyl)-5-methoxytryptamine

CAS Number
115007-18-6
Molecular Formula
C17H16N4O5
Molecular Weight
356.11206 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (10 patents) Pharmaceutical Intermediates (16 patents)

Technical Specifications

Molecular FormulaC17H16N4O5
Molecular Weight356.11206 g/mol
XLogP4.2
Topological Polar Surface Area (TPSA)129.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds5
Exact Mass356.11206 Da
Heavy Atoms26
Complexity508.0
SMILESCOC1=CC2=C(C=C1)NC=C2CCNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]
InChIKeyODQMCTXUHFTMIE-UHFFFAOYSA-N

Chemical Property Profile of ML 23

XLogP
4.2
TPSA (Topological Polar Surface Area)
129.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
5
Heavy Atoms
26
Complexity
508.0
Exact Mass
356.11206
Monoisotopic Mass
356.11206
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 ML 23

The XLogP value of 4.2 indicates that ML 23 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ML 23. Following Lipinski's Rule of Five, ML 23 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of ML 23?

The CAS number of ML 23 is 115007-18-6.

What is the molecular formula of ML 23?

The molecular formula of ML 23 is C17H16N4O5.

What is the molecular weight of ML 23?

The molecular weight of ML 23 is 356.11206 g/mol.

Where can I buy ML 23?

You can request a quote for ML 23 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for ML 23?

Yes, CoreyChem provides custom synthesis services for ML 23 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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