![3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol structure](/static/products/8282/828268-55-9.webp)
3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol
TL;DR: 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol (CAS 828268-55-9) is a chemical compound with molecular formula C32H37N3O3S and molecular weight 543.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol
3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]-1-benzothiophen-6-ol
Also Known As: 1d3p, 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol, 3-(4-(2-(Pyrrolidin-1-yl)ethoxy)benzyl)-2-(6-(2-(pyrrolidin-1-yl)ethoxy)pyridin-3-yl)benzo[b]thiophen-6-ol, 3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]-1-benzothiophen-6-ol, 3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-2-[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]-1-benzothiophene-6-ol
| Molecular Formula | C32H37N3O3S |
|---|---|
| Molecular Weight | 543.26 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 543.25555 |
| Heavy Atoms | 39 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 828268-55-9 |
|---|---|
| SMILES | C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CN=C(C=C5)OCCN6CCCC6 |
| InChIKey | KEDLOQLGBOISAT-UHFFFAOYSA-N |
Product Overview
3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol (CAS 828268-55-9), with molecular formula C32H37N3O3S and molecular weight 543.26 g/mol. IUPAC: 3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]-1-benzothiophen-6-ol.
Chemical Property Profile of 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol
Property Insights of 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol
The XLogP value of 6.4 indicates that 1d3p is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(2-pyrrolidin-1-yl-ethoxy)-benzyl]-2-4-(2-pyrrolidin-1-yl-ethoxy)-phenyl] -benzo[b]thiophen-6-ol. Following Lipinski's Rule of Five, 1d3p has 1 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 1d3p?
The CAS number of 1d3p is 828268-55-9.
What is the molecular formula of 1d3p?
The molecular formula of 1d3p is C32H37N3O3S.
What is the molecular weight of 1d3p?
The molecular weight of 1d3p is 543.26 g/mol.
Where can I buy 1d3p?
You can request a quote for 1d3p directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1d3p?
Yes, KEHONG BIO provides custom synthesis services for 1d3p and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.