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RefChem:221097 structure
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RefChem:221097

TL;DR: RefChem:221097 (CAS 13073-17-1) is a chemical compound with molecular formula C34H48N4O2 and molecular weight 544.37775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(14-acetyl-7,16-diphenyl-1,5,10,14-tetrazatricyclo[14.2.2.27,10]docosan-5-yl)ethanone

Also Known As: I.S. 3359, 1,5,10,14-Tetraazatricyclo(14.2.2.2(sup 7,10))docosane, 5,14-diacetyl-7,16-diphenyl-, 3,12-Diacetil-1,10-difenil-3,7,12,16-tetraazatriciclo(14,2,2,2(sup 7,10))docosano [Italian], 5,14-Diacetyl-7,16-diphenyl-1,5,10,14-tetraazatricyclo(14.2.2.2(sup 7,10))docosane, 3,12-Diacetil-1,10-difenil-3,7,12,16-tetraazatriciclo(14,2,2,2(sup 7,10))docosano

CAS Number
13073-17-1
Molecular Formula
C34H48N4O2
Molecular Weight
544.37775 g/mol
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Technical Specifications

Molecular FormulaC34H48N4O2
Molecular Weight544.37775 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)47.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass544.37775 Da
Heavy Atoms40
Complexity750.0
SMILESCC(=O)N1CCCN2CCC(CC2)(CN(CCCN3CCC(C1)(CC3)C4=CC=CC=C4)C(=O)C)C5=CC=CC=C5
InChIKeyCCUDVEANUNTZKL-UHFFFAOYSA-N

Chemical Property Profile of RefChem:221097

XLogP
4.3
TPSA (Topological Polar Surface Area)
47.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
40
Complexity
750.0
Exact Mass
544.37775
Monoisotopic Mass
544.37775
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 RefChem:221097

The XLogP value of 4.3 indicates that RefChem:221097 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.1 Ų, RefChem:221097 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:221097 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of RefChem:221097?

The CAS number of RefChem:221097 is 13073-17-1.

What is the molecular formula of RefChem:221097?

The molecular formula of RefChem:221097 is C34H48N4O2.

What is the molecular weight of RefChem:221097?

The molecular weight of RefChem:221097 is 544.37775 g/mol.

Where can I buy RefChem:221097?

You can request a quote for RefChem:221097 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:221097?

Yes, CoreyChem provides custom synthesis services for RefChem:221097 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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