A2105/0088458
TL;DR: A2105/0088458 (CAS 309283-04-3) is a chemical compound with molecular formula C18H14N2O6 and molecular weight 354.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: A2105/0088458, (4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione, 3-HYDROXY-4-(4-METHOXYBENZOYL)-5-(3-NITROPHENYL)-2,5-DIHYDRO-1H-PYRROL-2-ONE, 3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C18H14N2O6 |
|---|---|
| Molecular Weight | 354.09 g/mol |
| LogP | 2.3127 |
| Topological Polar Surface Area | 118.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.08517 |
| Heavy Atoms | 26 |
| Complexity | 932.95245 |
Chemical Identifiers
| CAS Number | 309283-04-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C(=C\2/C(NC(=O)C2=O)C3=CC(=CC=C3)[N+](=O)[O-])/O |
Product Overview
A2105/0088458 (CAS 309283-04-3), with molecular formula C18H14N2O6 and molecular weight 354.09 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of A2105/0088458
Property Insights of A2105/0088458
The XLogP value of 2.3127 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2105/0088458. The TPSA of 118.77 Ų falls within the moderate polarity range, balancing permeability and solubility for A2105/0088458. Following Lipinski's Rule of Five, A2105/0088458 has 2 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 A2105/0088458?
The CAS number of A2105/0088458 is 309283-04-3.
What is the molecular formula of A2105/0088458?
The molecular formula of A2105/0088458 is C18H14N2O6.
What is the molecular weight of A2105/0088458?
The molecular weight of A2105/0088458 is 354.09 g/mol.
Where can I buy A2105/0088458?
You can request a quote for A2105/0088458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2105/0088458?
Yes, KEHONG BIO provides custom synthesis services for A2105/0088458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.