A2864/0120781
TL;DR: A2864/0120781 (CAS 488100-13-6) is a chemical compound with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-[4-(dimethylamino)phenyl]-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
Also Known As: A2864/0120781, (4E)-5-(4-dimethylaminophenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
| Molecular Formula | C26H31N3O4 |
|---|---|
| Molecular Weight | 449.23 g/mol |
| LogP | 2.81492 |
| Topological Polar Surface Area | 73.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.23145 |
| Heavy Atoms | 33 |
| Complexity | 1038.2117 |
Chemical Identifiers
| CAS Number | 488100-13-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)N(C)C)/O |
Product Overview
A2864/0120781 (CAS 488100-13-6), with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol. IUPAC: (4E)-5-[4-(dimethylamino)phenyl]-4-[hydroxy-(4-methylphenyl)methylidene]-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of A2864/0120781
Property Insights of A2864/0120781
The XLogP value of 2.81492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2864/0120781. The TPSA of 73.32 Ų falls within the moderate polarity range, balancing permeability and solubility for A2864/0120781. Following Lipinski's Rule of Five, A2864/0120781 has 1 hydrogen bond donor(s) and 6 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 A2864/0120781?
The CAS number of A2864/0120781 is 488100-13-6.
What is the molecular formula of A2864/0120781?
The molecular formula of A2864/0120781 is C26H31N3O4.
What is the molecular weight of A2864/0120781?
The molecular weight of A2864/0120781 is 449.23 g/mol.
Where can I buy A2864/0120781?
You can request a quote for A2864/0120781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2864/0120781?
Yes, KEHONG BIO provides custom synthesis services for A2864/0120781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.