L643,717-01J10
TL;DR: L643,717-01J10 (CAS 85648-09-5) is a chemical compound with molecular formula C26H31Cl2N3O4S and molecular weight 551.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(5-thiophen-2-yl-1H-imidazol-2-yl)phenoxy]propan-2-ol;dihydrochloride
Also Known As: L643,717-01J10, L 643717-01J10, L-643717-01J10, 1-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-3-{4-[4-(thiophen-2-yl)-1H-imidazol-2-yl]phenoxy}propan-2-ol--hydrogen chloride (1/2), (2-(3-(3,4-Dimethoxyphenethylamino)-2-hydroxypropoxy)phenyl)-4-(2-thienyl)imidazole dihydrochloride
| Molecular Formula | C26H31Cl2N3O4S |
|---|---|
| Molecular Weight | 551.14 g/mol |
| LogP | 5.238 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 551.14124 |
| Heavy Atoms | 36 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 85648-09-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNCC(COC2=CC=C(C=C2)C3=NC=C(N3)C4=CC=CS4)O)OC.Cl.Cl |
| InChIKey | FUNPLUUFCGTLEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
L643,717-01J10 (CAS 85648-09-5), with molecular formula C26H31Cl2N3O4S and molecular weight 551.14 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-(5-thiophen-2-yl-1H-imidazol-2-yl)phenoxy]propan-2-ol;dihydrochloride.
Chemical Property Profile of L643,717-01J10
Property Insights of L643,717-01J10
The XLogP value of 5.238 indicates that L643,717-01J10 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L643,717-01J10. Following Lipinski's Rule of Five, L643,717-01J10 has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of L643,717-01J10?
The CAS number of L643,717-01J10 is 85648-09-5.
What is the molecular formula of L643,717-01J10?
The molecular formula of L643,717-01J10 is C26H31Cl2N3O4S.
What is the molecular weight of L643,717-01J10?
The molecular weight of L643,717-01J10 is 551.14 g/mol.
Where can I buy L643,717-01J10?
You can request a quote for L643,717-01J10 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L643,717-01J10?
Yes, KEHONG BIO provides custom synthesis services for L643,717-01J10 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.