A3830/0162676
TL;DR: A3830/0162676 (CAS 728002-80-0) is a chemical compound with molecular formula C26H26N4O4S2 and molecular weight 522.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-1-[2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonylimidazolidin-1-yl]ethanone
Also Known As: A3830/0162676, 2-(1H-benzimidazol-2-ylsulfanyl)-1-[2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonylimidazolidin-1-yl]ethanone, 2-(1H-1,3-BENZIMIDAZOL-2-YLSULFANYL)-1-{2-(4-METHOXYPHENYL)-3-[(4-METHYLPHENYL)SULFONYL]-1-IMIDAZOLIDINYL}-1-ETHANONE, 2-(1H-benzimidazol-2-ylsulfanyl)-1-{2-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonyl]imidazolidin-1-yl}ethanone
| Molecular Formula | C26H26N4O4S2 |
|---|---|
| Molecular Weight | 522.14 g/mol |
| LogP | 4.20392 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 522.1395 |
| Heavy Atoms | 36 |
| Complexity | 1451.6749 |
Chemical Identifiers
| CAS Number | 728002-80-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C2C3=CC=C(C=C3)OC)C(=O)CSC4=NC5=CC=CC=C5N4 |
Product Overview
A3830/0162676 (CAS 728002-80-0), with molecular formula C26H26N4O4S2 and molecular weight 522.14 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-1-[2-(4-methoxyphenyl)-3-(4-methylphenyl)sulfonylimidazolidin-1-yl]ethanone.
Chemical Property Profile of A3830/0162676
Property Insights of A3830/0162676
The XLogP value of 4.20392 indicates that A3830/0162676 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for A3830/0162676. Following Lipinski's Rule of Five, A3830/0162676 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3830/0162676?
The CAS number of A3830/0162676 is 728002-80-0.
What is the molecular formula of A3830/0162676?
The molecular formula of A3830/0162676 is C26H26N4O4S2.
What is the molecular weight of A3830/0162676?
The molecular weight of A3830/0162676 is 522.14 g/mol.
Where can I buy A3830/0162676?
You can request a quote for A3830/0162676 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3830/0162676?
Yes, KEHONG BIO provides custom synthesis services for A3830/0162676 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.