BRL 35135A
TL;DR: BRL 35135A (CAS 86615-41-0) is a chemical compound with molecular formula C20H25BrClNO4 and molecular weight 457.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]phenoxy]acetate;hydrobromide
Also Known As: BRL 35135A, BRL-35135A, Acetic acid, (4-((2R)-2-(((2R)-2-(3-chlorophenyl)-2-hydroxyethyl)amino)propyl)phenoxy)-, methyl ester, hydrobromide, rel-, Methyl [4-(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}propyl)phenoxy]acetate--hydrogen bromide (1/1), Methyl [4-(2-{[2-(3-chlorophenyl)-2-hydroxyethyl]amino}propyl)phenoxy]acetate--hydrogen bromide (1/1)
| Molecular Formula | C20H25BrClNO4 |
|---|---|
| Molecular Weight | 457.07 g/mol |
| LogP | 3.7239 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 457.06555 |
| Heavy Atoms | 27 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 86615-41-0 |
|---|---|
| SMILES | CC(CC1=CC=C(C=C1)OCC(=O)OC)NC[C@@H](C2=CC(=CC=C2)Cl)O.Br |
| InChIKey | LPDGLMPJFGGZGN-XEJVECFOSA-N |
Product Overview
BRL 35135A (CAS 86615-41-0), with molecular formula C20H25BrClNO4 and molecular weight 457.07 g/mol. IUPAC: methyl 2-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]phenoxy]acetate;hydrobromide.
Chemical Property Profile of BRL 35135A
Property Insights of BRL 35135A
The XLogP value of 3.7239 indicates that BRL 35135A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BRL 35135A. Following Lipinski's Rule of Five, BRL 35135A has 3 hydrogen bond donor(s) and 5 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 BRL 35135A?
The CAS number of BRL 35135A is 86615-41-0.
What is the molecular formula of BRL 35135A?
The molecular formula of BRL 35135A is C20H25BrClNO4.
What is the molecular weight of BRL 35135A?
The molecular weight of BRL 35135A is 457.07 g/mol.
Where can I buy BRL 35135A?
You can request a quote for BRL 35135A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRL 35135A?
Yes, KEHONG BIO provides custom synthesis services for BRL 35135A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.