A3411/0144701
TL;DR: A3411/0144701 (CAS 473573-79-4) is a chemical compound with molecular formula C20H20BrN3O2S and molecular weight 445.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-benzyl-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-bromophenyl)acetamide
Also Known As: A3411/0144701, 2-(3-benzyl-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-bromophenyl)acetamide, 2-(3-benzyl-1-ethyl-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-bromophenyl)acetamide
| Molecular Formula | C20H20BrN3O2S |
|---|---|
| Molecular Weight | 445.05 g/mol |
| LogP | 3.7955 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.04596 |
| Heavy Atoms | 27 |
| Complexity | 842.0651 |
Chemical Identifiers
| CAS Number | 473573-79-4 |
|---|---|
| SMILES | CCN1C(=O)C(N(C1=S)CC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)Br |
Product Overview
A3411/0144701 (CAS 473573-79-4), with molecular formula C20H20BrN3O2S and molecular weight 445.05 g/mol. IUPAC: 2-(3-benzyl-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-bromophenyl)acetamide.
Chemical Property Profile of A3411/0144701
Property Insights of A3411/0144701
The XLogP value of 3.7955 indicates that A3411/0144701 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, A3411/0144701 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3411/0144701 has 1 hydrogen bond donor(s) and 3 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 A3411/0144701?
The CAS number of A3411/0144701 is 473573-79-4.
What is the molecular formula of A3411/0144701?
The molecular formula of A3411/0144701 is C20H20BrN3O2S.
What is the molecular weight of A3411/0144701?
The molecular weight of A3411/0144701 is 445.05 g/mol.
Where can I buy A3411/0144701?
You can request a quote for A3411/0144701 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3411/0144701?
Yes, KEHONG BIO provides custom synthesis services for A3411/0144701 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.