A 58365B
TL;DR: A 58365B (CAS 87896-53-5) is a chemical compound with molecular formula C13H15NO6 and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-carboxyethyl)-9-hydroxy-6-oxo-1,2,3,4-tetrahydroquinolizine-4-carboxylic acid
Also Known As: A-58365B, A 58365B, A 58365 B, 2H-Quinolizine-7-propanoic acid, 4-carboxy-1,3,4,6-tetrahydro-9-hydroxy-6-oxo-, 4-Carboxy-1,3,4,6-tetrahydro-9-hydroxy-6-oxo-2H-quinolizine-7-propanoic acid
| Molecular Formula | C13H15NO6 |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.08994 |
| Heavy Atoms | 20 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 87896-53-5 |
|---|---|
| SMILES | C1CC(N2C(=C(C=C(C2=O)CCC(=O)O)O)C1)C(=O)O |
| InChIKey | UJJUUOQJYAUBKD-UHFFFAOYSA-N |
Product Overview
A 58365B (CAS 87896-53-5), with molecular formula C13H15NO6 and molecular weight 281.09 g/mol. IUPAC: 7-(2-carboxyethyl)-9-hydroxy-6-oxo-1,2,3,4-tetrahydroquinolizine-4-carboxylic acid.
Chemical Property Profile of A 58365B
Property Insights of A 58365B
The XLogP value of -0.1 indicates that A 58365B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A 58365B. Following Lipinski's Rule of Five, A 58365B has 3 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 A 58365B?
The CAS number of A 58365B is 87896-53-5.
What is the molecular formula of A 58365B?
The molecular formula of A 58365B is C13H15NO6.
What is the molecular weight of A 58365B?
The molecular weight of A 58365B is 281.09 g/mol.
Where can I buy A 58365B?
You can request a quote for A 58365B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A 58365B?
Yes, KEHONG BIO provides custom synthesis services for A 58365B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.