![(4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone structure](/static/products/6464/646455-98-3.webp)
(4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone
TL;DR: (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone (CAS 646455-98-3) is a chemical compound with molecular formula C20H26N2O4S and molecular weight 390.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,4-diazepan-1-yl]-thiophen-2-ylmethanone
Also Known As: ALTEPIASE, (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone, [4-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,4-diazepan-1-yl]-thiophen-2-ylmethanone, 1-(4-Bromo-2-fluorobenzyl)-1,4-diazepane, 1-(4-methoxyphenoxy)-3-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]propan-2-ol
| Molecular Formula | C20H26N2O4S |
|---|---|
| Molecular Weight | 390.16 g/mol |
| LogP | 2.3445 |
| Topological Polar Surface Area | 62.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.16132 |
| Heavy Atoms | 27 |
| Complexity | 705.2816 |
Chemical Identifiers
| CAS Number | 646455-98-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCC(CN2CCCN(CC2)C(=O)C3=CC=CS3)O |
Product Overview
(4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone (CAS 646455-98-3), with molecular formula C20H26N2O4S and molecular weight 390.16 g/mol. IUPAC: [4-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,4-diazepan-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone
Property Insights of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone
The XLogP value of 2.3445 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone. The TPSA of 62.24 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone. Following Lipinski's Rule of Five, (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone has 1 hydrogen bond donor(s) and 6 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 (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone?
The CAS number of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone is 646455-98-3.
What is the molecular formula of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone?
The molecular formula of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone is C20H26N2O4S.
What is the molecular weight of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone?
The molecular weight of (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone is 390.16 g/mol.
Where can I buy (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone?
You can request a quote for (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-[2-Hydroxy-3-(4-Methoxyphenoxy)Propyl]-1,4-Diazepan-1-Yl)(2-Thienyl)Methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.