B 1258
TL;DR: B 1258 (CAS 136996-63-9) is a chemical compound with molecular formula C18H28Cl3N3O2S and molecular weight 455.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethoxy]-4-methyl-1,3-thiazole;trihydrochloride
Also Known As: B 1258, 4-Methyl-5-(2-(4-o-ethoxyphenylpiperazin-1-yl)ethoxy)thiazole trihydrochloride, 1-(2-Ethoxyphenyl)-4-(2-((4-methyl-5-thiazolyl)oxy)ethyl)piperazine trihydrochloride, Piperazine, 1-(2-ethoxyphenyl)-4-(2-((4-methyl-5-thiazolyl)oxy)ethyl)-, trihydrochloride, 5-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethoxy]-4-methyl-1,3-thiazole trihydrochloride
| Molecular Formula | C18H28Cl3N3O2S |
|---|---|
| Molecular Weight | 455.10 g/mol |
| LogP | 4.31662 |
| Topological Polar Surface Area | 37.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.09677 |
| Heavy Atoms | 27 |
| Complexity | 652.287 |
Chemical Identifiers
| CAS Number | 136996-63-9 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2CCN(CC2)CCOC3=C(N=CS3)C.Cl.Cl.Cl |
Product Overview
B 1258 (CAS 136996-63-9), with molecular formula C18H28Cl3N3O2S and molecular weight 455.10 g/mol. IUPAC: 5-[2-[4-(2-ethoxyphenyl)piperazin-1-yl]ethoxy]-4-methyl-1,3-thiazole;trihydrochloride.
Chemical Property Profile of B 1258
Property Insights of B 1258
The XLogP value of 4.31662 indicates that B 1258 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.83 Ų, B 1258 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, B 1258 has 0 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 B 1258?
The CAS number of B 1258 is 136996-63-9.
What is the molecular formula of B 1258?
The molecular formula of B 1258 is C18H28Cl3N3O2S.
What is the molecular weight of B 1258?
The molecular weight of B 1258 is 455.10 g/mol.
Where can I buy B 1258?
You can request a quote for B 1258 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for B 1258?
Yes, KEHONG BIO provides custom synthesis services for B 1258 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.