RefChem:309642
TL;DR: RefChem:309642 (CAS 58687-61-9) is a chemical compound with molecular formula C15H22Cl3N5S and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-piperidin-1-ylethyl)imidazo[4,5-g][1,3]benzothiazol-2-amine;trihydrochloride
Also Known As: 6H-Imidazo(4,5-g)benzothiazole-2-amine, 6-(2-(1-piperidinyl)ethyl)-, trihydrochloride, 6-beta-Piperidinoethyl-2-amino-6H-imidazo(4,5-g)benzothiazole 3HCl, 6-(2-(1-Piperidinyl)ethyl)-6H-imidazo(4,5-g)benzothiazole-2-amine trihydrochloride, 6-(2-piperidin-1-ylethyl)imidazo[4,5-g][1,3]benzothiazol-2-amine trihydrochloride, 6-[2-(Piperidin-1-yl)ethyl]-6H-imidazo[4,5-g][1,3]benzothiazol-2-amine--hydrogen chloride (1/3)
| Molecular Formula | C15H22Cl3N5S |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 3.9795 |
| Topological Polar Surface Area | 59.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.06616 |
| Heavy Atoms | 24 |
| Complexity | 781.94867 |
Chemical Identifiers
| CAS Number | 58687-61-9 |
|---|---|
| SMILES | C1CCN(CC1)CCN2C=NC3=C2C=CC4=C3SC(=N4)N.Cl.Cl.Cl |
Product Overview
RefChem:309642 (CAS 58687-61-9), with molecular formula C15H22Cl3N5S and molecular weight 409.07 g/mol. IUPAC: 6-(2-piperidin-1-ylethyl)imidazo[4,5-g][1,3]benzothiazol-2-amine;trihydrochloride.
Chemical Property Profile of RefChem:309642
Property Insights of RefChem:309642
The XLogP value of 3.9795 indicates that RefChem:309642 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.97 Ų, RefChem:309642 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:309642 has 1 hydrogen bond donor(s) and 5 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 RefChem:309642?
The CAS number of RefChem:309642 is 58687-61-9.
What is the molecular formula of RefChem:309642?
The molecular formula of RefChem:309642 is C15H22Cl3N5S.
What is the molecular weight of RefChem:309642?
The molecular weight of RefChem:309642 is 409.07 g/mol.
Where can I buy RefChem:309642?
You can request a quote for RefChem:309642 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:309642?
Yes, KEHONG BIO provides custom synthesis services for RefChem:309642 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.