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AB00863973-06 structure
Fine Chemical

AB00863973-06

TL;DR: AB00863973-06 (CAS 1214136-50-1) is a chemical compound with molecular formula C27H22ClNO6 and molecular weight 491.11356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(4-chlorophenyl)-2-[[2-(8-methyl-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]propanoic acid

Also Known As: AB00863973-06, 3-(4-chlorophenyl)-2-(2-((8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy)acetamido)propanoic acid, 4-chloro-N-{[(8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]acetyl}phenylalanine, 3-(4-chlorophenyl)-2-[[2-(8-methyl-2-oxo-4-phenyl-chromen-7-yl)oxyacetyl]amino]propanoic Acid, 3-(4-chlorophenyl)-2-[[2-(8-methyl-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]propanoic acid

CAS Number
1214136-50-1
Molecular Formula
C27H22ClNO6
Molecular Weight
491.11356 g/mol
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Technical Specifications

Molecular FormulaC27H22ClNO6
Molecular Weight491.11356 g/mol
XLogP5.0
Topological Polar Surface Area (TPSA)102.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds8
Exact Mass491.11356 Da
Heavy Atoms35
Complexity801.0
SMILESCC1=C(C=CC2=C1OC(=O)C=C2C3=CC=CC=C3)OCC(=O)NC(CC4=CC=C(C=C4)Cl)C(=O)O
InChIKeyJJSVREANVSQQRU-UHFFFAOYSA-N

Chemical Property Profile of AB00863973-06

XLogP
5.0
TPSA (Topological Polar Surface Area)
102.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
8
Heavy Atoms
35
Complexity
801.0
Exact Mass
491.11356
Monoisotopic Mass
491.11356
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 AB00863973-06

The XLogP value of 5.0 indicates that AB00863973-06 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00863973-06. Following Lipinski's Rule of Five, AB00863973-06 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 AB00863973-06?

The CAS number of AB00863973-06 is 1214136-50-1.

What is the molecular formula of AB00863973-06?

The molecular formula of AB00863973-06 is C27H22ClNO6.

What is the molecular weight of AB00863973-06?

The molecular weight of AB00863973-06 is 491.11356 g/mol.

Where can I buy AB00863973-06?

You can request a quote for AB00863973-06 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AB00863973-06?

Yes, CoreyChem provides custom synthesis services for AB00863973-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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