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AB00864227-06 structure
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AB00864227-06

TL;DR: AB00864227-06 (CAS 1212378-13-6) is a chemical compound with molecular formula C21H24N2O5 and molecular weight 384.16852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(1S,9R)-11-(3,4,5-trimethoxybenzoyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Also Known As: AB00864227-06, (1R,5S)-3-(3,4,5-trimethoxybenzoyl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-one

CAS Number
1212378-13-6
Molecular Formula
C21H24N2O5
Molecular Weight
384.16852 g/mol
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Technical Specifications

Molecular FormulaC21H24N2O5
Molecular Weight384.16852 g/mol
XLogP1.7
Topological Polar Surface Area (TPSA)68.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds4
Exact Mass384.16852 Da
Heavy Atoms28
Complexity676.0
SMILESCOC1=CC(=CC(=C1OC)OC)C(=O)N2C[C@H]3C[C@@H](C2)C4=CC=CC(=O)N4C3
InChIKeyZAWJPZQSFHYQBJ-HIFRSBDPSA-N

Chemical Property Profile of AB00864227-06

XLogP
1.7
TPSA (Topological Polar Surface Area)
68.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
4
Heavy Atoms
28
Complexity
676.0
Exact Mass
384.16852
Monoisotopic Mass
384.16852
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 AB00864227-06

The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00864227-06. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00864227-06. Following Lipinski's Rule of Five, AB00864227-06 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of AB00864227-06?

The CAS number of AB00864227-06 is 1212378-13-6.

What is the molecular formula of AB00864227-06?

The molecular formula of AB00864227-06 is C21H24N2O5.

What is the molecular weight of AB00864227-06?

The molecular weight of AB00864227-06 is 384.16852 g/mol.

Where can I buy AB00864227-06?

You can request a quote for AB00864227-06 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for AB00864227-06?

Yes, CoreyChem provides custom synthesis services for AB00864227-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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