C22H28BrNOS.ClH
TL;DR: C22H28BrNOS.ClH (CAS 37094-62-5) is a chemical compound with molecular formula C22H29BrClNOS and molecular weight 469.08417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(8-bromobenzo[e][1]benzothiol-4-yl)-2-hydroxyethyl]-dibutylazanium chloride
Also Known As: Naphtho(2,1-b)thiophene-4-methanol, 8-bromo-alpha-((dibutylamino)methyl)-, hydrochloride, 8-Bromo-alpha-((dibutylamino)methyl)naphtho(2,1-b)thiophene-4-methanol hydrochloride, [2-(8-bromobenzo[e][1]benzothiol-4-yl)-2-hydroxyethyl]-dibutylazanium chloride
Technical Specifications
| Molecular Formula | C22H29BrClNOS |
| Molecular Weight | 469.08417 g/mol |
| XLogP | 2.34 |
| Topological Polar Surface Area (TPSA) | 52.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 469.08417 Da |
| Heavy Atoms | 27 |
| Complexity | 415.0 |
| SMILES | CCCC[NH+](CCCC)CC(C1=C2C(=C3C=C(C=CC3=C1)Br)C=CS2)O.[Cl-] |
| InChIKey | KPOIZQJGTGYJHE-UHFFFAOYSA-N |
Product Description
Applications: C22H28BrNOS.ClH is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
C22H28BrNOS.ClH is a fine chemical identified by CAS number 37094-62-5 and the molecular formula C22H29BrClNOS and a molecular weight of 469.08 g/mol. Synonyms include Naphtho(2,1-b)thiophene-4-methanol, 8-bromo-alpha-((dibutylamino)methyl)-, hydrochloride and 8-Bromo-alpha-((dibutylamino)methyl)naphtho(2,1-b)thiophene-4-methanol hydrochloride.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of C22H28BrNOS.ClH
Property Insights of C22H28BrNOS.ClH
The XLogP value of 2.34 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C22H28BrNOS.ClH. With a topological polar surface area (TPSA) of 52.9 Ų, C22H28BrNOS.ClH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C22H28BrNOS.ClH has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C22H28BrNOS.ClH?
The CAS number of C22H28BrNOS.ClH is 37094-62-5.
What is the molecular formula of C22H28BrNOS.ClH?
The molecular formula of C22H28BrNOS.ClH is C22H29BrClNOS.
What is the molecular weight of C22H28BrNOS.ClH?
The molecular weight of C22H28BrNOS.ClH is 469.08417 g/mol.
What are the applications of C22H28BrNOS.ClH?
C22H28BrNOS.ClH is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy C22H28BrNOS.ClH?
You can request a quote for C22H28BrNOS.ClH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C22H28BrNOS.ClH?
Yes, CoreyChem provides custom synthesis services for C22H28BrNOS.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.