AR-013/42256282
TL;DR: AR-013/42256282 (CAS 254899-45-1) is a chemical compound with molecular formula C11H11Br2NO5 and molecular weight 394.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,6-dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)propanoic acid
Also Known As: AR-013/42256282, 2-(8,9-dibromo-3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-4-yl)propanoic acid, 2-(5,6-Dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)propanoic acid
| Molecular Formula | C11H11Br2NO5 |
|---|---|
| Molecular Weight | 394.90 g/mol |
| LogP | 0.3687 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.9004 |
| Heavy Atoms | 19 |
| Complexity | 451.706 |
Chemical Identifiers
| CAS Number | 254899-45-1 |
|---|---|
| SMILES | CC(C(=O)O)N1C(=O)C2C(C1=O)C3C(C(C2O3)Br)Br |
Product Overview
AR-013/42256282 (CAS 254899-45-1), with molecular formula C11H11Br2NO5 and molecular weight 394.90 g/mol. IUPAC: 2-(5,6-dibromo-1,3-dioxo-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindol-2-yl)propanoic acid.
Chemical Property Profile of AR-013/42256282
Property Insights of AR-013/42256282
The XLogP value of 0.3687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AR-013/42256282. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AR-013/42256282. Following Lipinski's Rule of Five, AR-013/42256282 has 1 hydrogen bond donor(s) and 4 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 AR-013/42256282?
The CAS number of AR-013/42256282 is 254899-45-1.
What is the molecular formula of AR-013/42256282?
The molecular formula of AR-013/42256282 is C11H11Br2NO5.
What is the molecular weight of AR-013/42256282?
The molecular weight of AR-013/42256282 is 394.90 g/mol.
Where can I buy AR-013/42256282?
You can request a quote for AR-013/42256282 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AR-013/42256282?
Yes, KEHONG BIO provides custom synthesis services for AR-013/42256282 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.