AB01304654-01
TL;DR: AB01304654-01 (CAS 882245-98-9) is a chemical compound with molecular formula C22H28N4O5 and molecular weight 428.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-morpholin-4-ylpropylamino)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Also Known As: AB01304654-01, 5-((3-Morpholinopropyl)amino)-2-(3,4,5-trimethoxystyryl)oxazole-4-carbonitrile, 2-[(1E)-2-(3,4,5-trimethoxyphenyl)vinyl]-5-[(3-morpholin-4-ylpropyl)amino]-1,3 -oxazole-4-carbonitrile, 5-(3-morpholin-4-ylpropylamino)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile, 5-(3-morpholin-4-ylpropylamino)-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
| Molecular Formula | C22H28N4O5 |
|---|---|
| Molecular Weight | 428.21 g/mol |
| LogP | 2.87668 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 428.20596 |
| Heavy Atoms | 31 |
| Complexity | 903.46295 |
Chemical Identifiers
| CAS Number | 882245-98-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C2=NC(=C(O2)NCCCN3CCOCC3)C#N |
Product Overview
AB01304654-01 (CAS 882245-98-9), with molecular formula C22H28N4O5 and molecular weight 428.21 g/mol. IUPAC: 5-(3-morpholin-4-ylpropylamino)-2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile.
Chemical Property Profile of AB01304654-01
Property Insights of AB01304654-01
The XLogP value of 2.87668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01304654-01. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01304654-01. Following Lipinski's Rule of Five, AB01304654-01 has 1 hydrogen bond donor(s) and 9 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 AB01304654-01?
The CAS number of AB01304654-01 is 882245-98-9.
What is the molecular formula of AB01304654-01?
The molecular formula of AB01304654-01 is C22H28N4O5.
What is the molecular weight of AB01304654-01?
The molecular weight of AB01304654-01 is 428.21 g/mol.
Where can I buy AB01304654-01?
You can request a quote for AB01304654-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01304654-01?
Yes, KEHONG BIO provides custom synthesis services for AB01304654-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.