BAS 02212589
TL;DR: BAS 02212589 (CAS 128691-53-2) is a chemical compound with molecular formula C22H17NO5 and molecular weight 375.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate
Also Known As: BAS 02212589, AH-487/14757907, methyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate, methyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate, METHYL 4-(2H-1,3-BENZODIOXOL-5-YL)-2-METHYL-5-OXO-1H,4H,5H-INDENO[1,2-B]PYRIDINE-3-CARBOXYLATE
| Molecular Formula | C22H17NO5 |
|---|---|
| Molecular Weight | 375.11 g/mol |
| LogP | 3.1567 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.1107 |
| Heavy Atoms | 28 |
| Complexity | 1111.6603 |
Chemical Identifiers
| CAS Number | 128691-53-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC5=C(C=C4)OCO5)C(=O)OC |
Product Overview
BAS 02212589 (CAS 128691-53-2), with molecular formula C22H17NO5 and molecular weight 375.11 g/mol. IUPAC: methyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate.
Chemical Property Profile of BAS 02212589
Property Insights of BAS 02212589
The XLogP value of 3.1567 indicates that BAS 02212589 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02212589. Following Lipinski's Rule of Five, BAS 02212589 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 BAS 02212589?
The CAS number of BAS 02212589 is 128691-53-2.
What is the molecular formula of BAS 02212589?
The molecular formula of BAS 02212589 is C22H17NO5.
What is the molecular weight of BAS 02212589?
The molecular weight of BAS 02212589 is 375.11 g/mol.
Where can I buy BAS 02212589?
You can request a quote for BAS 02212589 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02212589?
Yes, KEHONG BIO provides custom synthesis services for BAS 02212589 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.