A3796/0161163
TL;DR: A3796/0161163 (CAS 727685-07-6) is a chemical compound with molecular formula C20H21BrN4O2 and molecular weight 428.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[2-(2-methoxyethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]benzamide
Also Known As: A3796/0161163, 3-bromo-N-[2-(2-methoxyethyl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-8-yl]benzamide, 3-bromo-N-[2-(2-methoxyethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]benzamide, 3-bromo-N-(2-(2-methoxyethyl)-1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-a]pyrazin-8-yl)benzamide
| Molecular Formula | C20H21BrN4O2 |
|---|---|
| Molecular Weight | 428.08 g/mol |
| LogP | 3.5131 |
| Topological Polar Surface Area | 59.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.08478 |
| Heavy Atoms | 27 |
| Complexity | 985.2722 |
Chemical Identifiers
| CAS Number | 727685-07-6 |
|---|---|
| SMILES | COCCN1CCN2C(=NC3=C2C=CC(=C3)NC(=O)C4=CC(=CC=C4)Br)C1 |
Product Overview
A3796/0161163 (CAS 727685-07-6), with molecular formula C20H21BrN4O2 and molecular weight 428.08 g/mol. IUPAC: 3-bromo-N-[2-(2-methoxyethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]benzamide.
Chemical Property Profile of A3796/0161163
Property Insights of A3796/0161163
The XLogP value of 3.5131 indicates that A3796/0161163 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.39 Ų, A3796/0161163 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3796/0161163 has 1 hydrogen bond donor(s) and 4 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 A3796/0161163?
The CAS number of A3796/0161163 is 727685-07-6.
What is the molecular formula of A3796/0161163?
The molecular formula of A3796/0161163 is C20H21BrN4O2.
What is the molecular weight of A3796/0161163?
The molecular weight of A3796/0161163 is 428.08 g/mol.
Where can I buy A3796/0161163?
You can request a quote for A3796/0161163 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3796/0161163?
Yes, KEHONG BIO provides custom synthesis services for A3796/0161163 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.