Pretamazium
TL;DR: Pretamazium (CAS 736867-77-9) is a chemical compound with molecular formula C29H29N2S+ and molecular weight 437.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-4-(4-phenylphenyl)-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-1,3-thiazol-3-ium
Also Known As: Pretamazium, Pretamazium [WHO-DD], Pretamazium iodide, Pretamazium iodide [INN:BAN], 4-(4-Biphenylyl)-3-ethyl-2-(p-1-pyrrolidinylstyryl)thiazolium
| Molecular Formula | C29H29N2S+ |
|---|---|
| Molecular Weight | 437.21 g/mol |
| LogP | 7.1601 |
| Topological Polar Surface Area | 7.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.20514 |
| Heavy Atoms | 32 |
| Complexity | 1182.4077 |
Chemical Identifiers
| CAS Number | 736867-77-9 |
|---|---|
| SMILES | CC[N+]1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)/C=C/C4=CC=C(C=C4)N5CCCC5 |
Product Overview
Pretamazium (CAS 736867-77-9), with molecular formula C29H29N2S+ and molecular weight 437.21 g/mol. IUPAC: 3-ethyl-4-(4-phenylphenyl)-2-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]-1,3-thiazol-3-ium.
Chemical Property Profile of Pretamazium
Property Insights of Pretamazium
The XLogP value of 7.1601 indicates that Pretamazium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 7.12 Ų, Pretamazium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pretamazium has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pretamazium?
The CAS number of Pretamazium is 736867-77-9.
What is the molecular formula of Pretamazium?
The molecular formula of Pretamazium is C29H29N2S+.
What is the molecular weight of Pretamazium?
The molecular weight of Pretamazium is 437.21 g/mol.
Where can I buy Pretamazium?
You can request a quote for Pretamazium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pretamazium?
Yes, KEHONG BIO provides custom synthesis services for Pretamazium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.