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AB00864506-06 structure
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AB00864506-06

TL;DR: AB00864506-06 (CAS 1214864-54-6) is a chemical compound with molecular formula C27H22N2O7 and molecular weight 486.1427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(5-hydroxy-1H-indol-3-yl)-2-[2-(6-oxobenzo[c]chromen-3-yl)oxypropanoylamino]propanoic acid

Also Known As: AB00864506-06, 3-(5-hydroxy-1H-indol-3-yl)-2-(2-((6-oxo-6H-benzo[c]chromen-3-yl)oxy)propanamido)propanoic acid, 5-hydroxy-N-{2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoyl}tryptophan, 3-(5-hydroxy-1H-indol-3-yl)-2-[2-(6-oxobenzo[c]chromen-3-yl)oxypropanoylamino]propanoic acid

CAS Number
1214864-54-6
Molecular Formula
C27H22N2O7
Molecular Weight
486.1427 g/mol
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Technical Specifications

Molecular FormulaC27H22N2O7
Molecular Weight486.1427 g/mol
XLogP4.1
Topological Polar Surface Area (TPSA)138.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors7
Rotatable Bonds7
Exact Mass486.1427 Da
Heavy Atoms36
Complexity837.0
SMILESCC(C(=O)NC(CC1=CNC2=C1C=C(C=C2)O)C(=O)O)OC3=CC4=C(C=C3)C5=CC=CC=C5C(=O)O4
InChIKeyMDKAWFIEKHSDSV-UHFFFAOYSA-N

Chemical Property Profile of AB00864506-06

XLogP
4.1
TPSA (Topological Polar Surface Area)
138.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
36
Complexity
837.0
Exact Mass
486.1427
Monoisotopic Mass
486.1427
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 AB00864506-06

The XLogP value of 4.1 indicates that AB00864506-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00864506-06. Following Lipinski's Rule of Five, AB00864506-06 has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of AB00864506-06?

The CAS number of AB00864506-06 is 1214864-54-6.

What is the molecular formula of AB00864506-06?

The molecular formula of AB00864506-06 is C27H22N2O7.

What is the molecular weight of AB00864506-06?

The molecular weight of AB00864506-06 is 486.1427 g/mol.

Where can I buy AB00864506-06?

You can request a quote for AB00864506-06 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AB00864506-06?

Yes, CoreyChem provides custom synthesis services for AB00864506-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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