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Cromoglicate lisetil structure
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Cromoglicate lisetil

TL;DR: Cromoglicate lisetil (CAS 110816-79-0) is a chemical compound with molecular formula C33H36N2O12 and molecular weight 652.2268 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 5-[2-[(2S)-2,6-diaminohexanoyl]oxy-3-(2-ethoxycarbonyl-4-oxochromen-5-yl)oxypropoxy]-4-oxochromene-2-carboxylate

Also Known As: Cromoglicate lisetil, Cromoglicato lisetilo, Cromoglicate etilisate, Cromoglicate lisetil [INN], Cromoglicate lisetil (INN)

CAS Number
110816-79-0
Molecular Formula
C33H36N2O12
Molecular Weight
652.2268 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (24 patents) Organic Building Blocks (1 patents) Pharmaceutical Intermediates (30 patents)

Technical Specifications

Molecular FormulaC33H36N2O12
Molecular Weight652.2268 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)202.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors14
Rotatable Bonds19
Exact Mass652.2268 Da
Heavy Atoms47
Complexity1130.0
SMILESCCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OCC)OC(=O)[C@H](CCCCN)N
InChIKeyNGJJDHCBOKNREV-FQEVSTJZSA-N

Chemical Property Profile of Cromoglicate lisetil

XLogP
3.1
TPSA (Topological Polar Surface Area)
202.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
14
Rotatable Bonds
19
Heavy Atoms
47
Complexity
1130.0
Exact Mass
652.2268
Monoisotopic Mass
652.2268
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 Cromoglicate lisetil

The XLogP value of 3.1 indicates that Cromoglicate lisetil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 202.0 Ų indicates high polarity, suggesting Cromoglicate lisetil may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cromoglicate lisetil has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Cromoglicate lisetil?

The CAS number of Cromoglicate lisetil is 110816-79-0.

What is the molecular formula of Cromoglicate lisetil?

The molecular formula of Cromoglicate lisetil is C33H36N2O12.

What is the molecular weight of Cromoglicate lisetil?

The molecular weight of Cromoglicate lisetil is 652.2268 g/mol.

Where can I buy Cromoglicate lisetil?

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

Does CoreyChem offer custom synthesis for Cromoglicate lisetil?

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

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