ChemDiv1_001093
TL;DR: ChemDiv1_001093 (CAS 331983-55-2) is a chemical compound with molecular formula C20H22N4O2S2 and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-[1-(2-hydroxyethyl)benzimidazol-2-yl]sulfanylethylsulfanyl]benzimidazol-1-yl]ethanol
Also Known As: ChemDiv1_001093, 2-[2-[2-[1-(2-hydroxyethyl)benzimidazol-2-yl]sulfanylethylsulfanyl]benzimidazol-1-yl]ethanol, 2-{2-[(2-{[1-(2-hydroxyethyl)-1H-benzimidazol-2-yl]sulfanyl}ethyl)sulfanyl]-1H-benzimidazol-1-yl}ethanol, 2-(2-{2-[1-(2-hydroxyethyl)benzimidazol-2-ylthio]ethylthio}benzimidazolyl)etha n-1-ol, 2,2'-((Ethane-1,2-diylbis(sulfanediyl))bis(1H-benzo[d]imidazole-2,1-diyl))bis(ethan-1-ol)
| Molecular Formula | C20H22N4O2S2 |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 3.255 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 414.1184 |
| Heavy Atoms | 28 |
| Complexity | 990.6375 |
Chemical Identifiers
| CAS Number | 331983-55-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2CCO)SCCSC3=NC4=CC=CC=C4N3CCO |
Product Overview
ChemDiv1_001093 (CAS 331983-55-2), with molecular formula C20H22N4O2S2 and molecular weight 414.12 g/mol. IUPAC: 2-[2-[2-[1-(2-hydroxyethyl)benzimidazol-2-yl]sulfanylethylsulfanyl]benzimidazol-1-yl]ethanol.
Chemical Property Profile of ChemDiv1_001093
Property Insights of ChemDiv1_001093
The XLogP value of 3.255 indicates that ChemDiv1_001093 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_001093. Following Lipinski's Rule of Five, ChemDiv1_001093 has 2 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 ChemDiv1_001093?
The CAS number of ChemDiv1_001093 is 331983-55-2.
What is the molecular formula of ChemDiv1_001093?
The molecular formula of ChemDiv1_001093 is C20H22N4O2S2.
What is the molecular weight of ChemDiv1_001093?
The molecular weight of ChemDiv1_001093 is 414.12 g/mol.
Where can I buy ChemDiv1_001093?
You can request a quote for ChemDiv1_001093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_001093?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_001093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.