RefChem:381216
TL;DR: RefChem:381216 (CAS 52419-77-9) is a chemical compound with molecular formula C25H41Br2N3O2S and molecular weight 605.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-1'-octylspiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol;dihydrobromide
Also Known As: Spiro(piperidine-4,6'(7'H)-(5H)thiazolo(3,2-a)pyrimidin)-3'-ol, 2',3'-dihydro-3'-(2-methoxyphenyl)-1-octyl-, dihydrobromide, 3'-(2-Methoxyphenyl)-1-octyl-2',3'-dihydro-5'H,7'H-spiro[piperidine-4,6'-[1,3]thiazolo[3,2-a]pyrimidin]-3'-ol--hydrogen bromide (1/2), 3-(2-methoxyphenyl)-1'-octylspiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol dihydrobromide, RefChem:381216
| Molecular Formula | C25H41Br2N3O2S |
|---|---|
| Molecular Weight | 605.13 g/mol |
| LogP | 5.8572 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 605.1286 |
| Heavy Atoms | 33 |
| Complexity | 773.77386 |
Chemical Identifiers
| CAS Number | 52419-77-9 |
|---|---|
| SMILES | CCCCCCCCN1CCC2(CC1)CN=C3N(C2)C(CS3)(C4=CC=CC=C4OC)O.Br.Br |
Product Overview
RefChem:381216 (CAS 52419-77-9), with molecular formula C25H41Br2N3O2S and molecular weight 605.13 g/mol. IUPAC: 3-(2-methoxyphenyl)-1'-octylspiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol;dihydrobromide.
Chemical Property Profile of RefChem:381216
Property Insights of RefChem:381216
The XLogP value of 5.8572 indicates that RefChem:381216 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, RefChem:381216 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:381216 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:381216?
The CAS number of RefChem:381216 is 52419-77-9.
What is the molecular formula of RefChem:381216?
The molecular formula of RefChem:381216 is C25H41Br2N3O2S.
What is the molecular weight of RefChem:381216?
The molecular weight of RefChem:381216 is 605.13 g/mol.
Where can I buy RefChem:381216?
You can request a quote for RefChem:381216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:381216?
Yes, KEHONG BIO provides custom synthesis services for RefChem:381216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.