GPR30 agonist-1
TL;DR: GPR30 agonist-1 (CAS 415919-74-3) is a chemical compound with molecular formula C19H17BrFNO and molecular weight 373.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,4R,9bR)-4-(5-bromo-2-methoxyphenyl)-8-fluoro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Also Known As: GPR30 agonist-1, (3aS,4R,9bR)-4-(5-bromo-2-methoxyphenyl)-8-fluoro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline, 3H-Cyclopenta[c]quinoline, 4-(5-bromo-2-methoxyphenyl)-8-fluoro-3a,4,5,9b-tetrahydro-, (3aS,4R,9bR)-
| Molecular Formula | C19H17BrFNO |
|---|---|
| Molecular Weight | 373.05 g/mol |
| LogP | 5.4233 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 373.04776 |
| Heavy Atoms | 23 |
| Complexity | 788.93427 |
Chemical Identifiers
| CAS Number | 415919-74-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)[C@H]2[C@H]3CC=C[C@H]3C4=C(N2)C=CC(=C4)F |
Product Overview
GPR30 agonist-1 (CAS 415919-74-3), with molecular formula C19H17BrFNO and molecular weight 373.05 g/mol. IUPAC: (3aS,4R,9bR)-4-(5-bromo-2-methoxyphenyl)-8-fluoro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline.
Chemical Property Profile of GPR30 agonist-1
Property Insights of GPR30 agonist-1
The XLogP value of 5.4233 indicates that GPR30 agonist-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, GPR30 agonist-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, GPR30 agonist-1 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of GPR30 agonist-1?
The CAS number of GPR30 agonist-1 is 415919-74-3.
What is the molecular formula of GPR30 agonist-1?
The molecular formula of GPR30 agonist-1 is C19H17BrFNO.
What is the molecular weight of GPR30 agonist-1?
The molecular weight of GPR30 agonist-1 is 373.05 g/mol.
Where can I buy GPR30 agonist-1?
You can request a quote for GPR30 agonist-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GPR30 agonist-1?
Yes, KEHONG BIO provides custom synthesis services for GPR30 agonist-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.