NCIOpen2_005073
TL;DR: NCIOpen2_005073 (CAS 6016-43-9) is a chemical compound with molecular formula C20H22O2 and molecular weight 294.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[4-(4-acetylphenyl)butyl]phenyl]ethanone
Also Known As: NCIOpen2_005073, p,p'-Tetramethylen-diacetophenon, 1-[4-[4-(4-acetylphenyl)butyl]phenyl]ethanone, 1-{4-[4-(4-acetylphenyl)butyl]phenyl}ethanone, 1,1'-(butane-1,4-diyldibenzene-4,1-diyl)diethanone
| Molecular Formula | C20H22O2 |
|---|---|
| Molecular Weight | 294.16 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 294.162 |
| Heavy Atoms | 22 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 6016-43-9 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)CCCCC2=CC=C(C=C2)C(=O)C |
| InChIKey | ZSNMJPFJWCHOJK-UHFFFAOYSA-N |
Product Overview
NCIOpen2_005073 (CAS 6016-43-9), with molecular formula C20H22O2 and molecular weight 294.16 g/mol. IUPAC: 1-[4-[4-(4-acetylphenyl)butyl]phenyl]ethanone.
Chemical Property Profile of NCIOpen2_005073
Property Insights of NCIOpen2_005073
The XLogP value of 4.6 indicates that NCIOpen2_005073 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, NCIOpen2_005073 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NCIOpen2_005073 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCIOpen2_005073?
The CAS number of NCIOpen2_005073 is 6016-43-9.
What is the molecular formula of NCIOpen2_005073?
The molecular formula of NCIOpen2_005073 is C20H22O2.
What is the molecular weight of NCIOpen2_005073?
The molecular weight of NCIOpen2_005073 is 294.16 g/mol.
Where can I buy NCIOpen2_005073?
You can request a quote for NCIOpen2_005073 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_005073?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_005073 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.