KST-1A5003
TL;DR: KST-1A5003 (CAS 485-65-4) is a chemical compound with molecular formula C15H19NO3 and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,11bS)-9-methoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine-3-carboxylic acid
Also Known As: KST-1A5003, (3r,11bs)-9-methoxy-1,3,4,6,7,11b-hexahydro-2h-pyrido[2,1-a]isoquinoline-3-carboxylic acid, J2.794.498A, (3R,11bS)-9-methoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine-3-carboxylic acid, (3R,11bS)-9-methoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quino
| Molecular Formula | C15H19NO3 |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.1365 |
| Heavy Atoms | 19 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 485-65-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)[C@@H]3CC[C@H](CN3CC2)C(=O)O |
| InChIKey | CMZIZIPSUFOSEU-RISCZKNCSA-N |
Product Overview
KST-1A5003 (CAS 485-65-4), with molecular formula C15H19NO3 and molecular weight 261.14 g/mol. IUPAC: (3R,11bS)-9-methoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine-3-carboxylic acid.
Chemical Property Profile of KST-1A5003
Property Insights of KST-1A5003
The XLogP value of -0.5 indicates that KST-1A5003 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.8 Ų, KST-1A5003 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A5003 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 KST-1A5003?
The CAS number of KST-1A5003 is 485-65-4.
What is the molecular formula of KST-1A5003?
The molecular formula of KST-1A5003 is C15H19NO3.
What is the molecular weight of KST-1A5003?
The molecular weight of KST-1A5003 is 261.14 g/mol.
Where can I buy KST-1A5003?
You can request a quote for KST-1A5003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A5003?
Yes, KEHONG BIO provides custom synthesis services for KST-1A5003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.