A1056/0049531
TL;DR: A1056/0049531 (CAS 6415-44-7) is a chemical compound with molecular formula C40H42N4O4 and molecular weight 642.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[4-[4-[[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-piperidin-1-ylethanone
Also Known As: A1056/0049531, 2-[4-[[4-[4-[[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-piperidin-1-ylethanone, 2-{4-[(E)-({4'-[(E)-({4-[2-OXO-2-(PIPERIDIN-1-YL)ETHOXY]PHENYL}METHYLIDENE)AMINO]-[1,1'-BIPHENYL]-4-YL}IMINO)METHYL]PHENOXY}-1-(PIPERIDIN-1-YL)ETHAN-1-ONE, 2,2'-{[1,1'-Biphenyl]-4,4'-diylbis[azanylylidene-(E)-methanylylidene-4,1-phenyleneoxy]}bis[1-(piperidin-1-yl)ethan-1-one]
| Molecular Formula | C40H42N4O4 |
|---|---|
| Molecular Weight | 642.32 g/mol |
| LogP | 7.6374 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 642.3206 |
| Heavy Atoms | 48 |
| Complexity | 1557.618 |
Chemical Identifiers
| CAS Number | 6415-44-7 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C=NC3=CC=C(C=C3)C4=CC=C(C=C4)N=CC5=CC=C(C=C5)OCC(=O)N6CCCCC6 |
Product Overview
A1056/0049531 (CAS 6415-44-7), with molecular formula C40H42N4O4 and molecular weight 642.32 g/mol. IUPAC: 2-[4-[[4-[4-[[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylideneamino]phenyl]phenyl]iminomethyl]phenoxy]-1-piperidin-1-ylethanone.
Chemical Property Profile of A1056/0049531
Property Insights of A1056/0049531
The XLogP value of 7.6374 indicates that A1056/0049531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for A1056/0049531. Following Lipinski's Rule of Five, A1056/0049531 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1056/0049531?
The CAS number of A1056/0049531 is 6415-44-7.
What is the molecular formula of A1056/0049531?
The molecular formula of A1056/0049531 is C40H42N4O4.
What is the molecular weight of A1056/0049531?
The molecular weight of A1056/0049531 is 642.32 g/mol.
Where can I buy A1056/0049531?
You can request a quote for A1056/0049531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1056/0049531?
Yes, KEHONG BIO provides custom synthesis services for A1056/0049531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.