AB01324022-02
TL;DR: AB01324022-02 (CAS 489443-04-1) is a chemical compound with molecular formula C18H17BrN2O6 and molecular weight 436.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O'-ethyl 3-O'-methyl 2'-amino-6-bromo-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
Also Known As: AB01324022-02, 5'-ethyl 3'-methyl 2'-amino-6-bromo-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate, 5'-ethyl 3'-methyl 2'-amino-6-bromo-6'-methyl-2-oxospiro[indoline-3,4'-pyran]-3',5'-dicarboxylate, 5-O'-ethyl 3-O'-methyl 2'-amino-6-bromo-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate, Ethyl Methyl 2'-amino-6-bromo-6'-methyl-2-oxo-spiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate
| Molecular Formula | C18H17BrN2O6 |
|---|---|
| Molecular Weight | 436.03 g/mol |
| LogP | 1.8496 |
| Topological Polar Surface Area | 116.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.027 |
| Heavy Atoms | 27 |
| Complexity | 935.7796 |
Chemical Identifiers
| CAS Number | 489443-04-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C(C12C3=C(C=C(C=C3)Br)NC2=O)C(=O)OC)N)C |
Product Overview
AB01324022-02 (CAS 489443-04-1), with molecular formula C18H17BrN2O6 and molecular weight 436.03 g/mol. IUPAC: 5-O'-ethyl 3-O'-methyl 2'-amino-6-bromo-6'-methyl-2-oxospiro[1H-indole-3,4'-pyran]-3',5'-dicarboxylate.
Chemical Property Profile of AB01324022-02
Property Insights of AB01324022-02
The XLogP value of 1.8496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01324022-02. The TPSA of 116.95 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01324022-02. Following Lipinski's Rule of Five, AB01324022-02 has 2 hydrogen bond donor(s) and 7 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 AB01324022-02?
The CAS number of AB01324022-02 is 489443-04-1.
What is the molecular formula of AB01324022-02?
The molecular formula of AB01324022-02 is C18H17BrN2O6.
What is the molecular weight of AB01324022-02?
The molecular weight of AB01324022-02 is 436.03 g/mol.
Where can I buy AB01324022-02?
You can request a quote for AB01324022-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01324022-02?
Yes, KEHONG BIO provides custom synthesis services for AB01324022-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.