RefChem:381212
TL;DR: RefChem:381212 (CAS 52419-67-7) is a chemical compound with molecular formula C22H35Br2N3O3S and molecular weight 579.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-butyl-3-(2,5-dimethoxyphenyl)spiro[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-1-butyl-3'-(2,5-dimethoxyphenyl)-, dihydrobromide, 1'-butyl-3-(2,5-dimethoxyphenyl)spiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol dihydrobromide, 1-Butyl-3'-(2,5-dimethoxyphenyl)-2',3'-dihydro-5'H,7'H-spiro[piperidine-4,6'-[1,3]thiazolo[3,2-a]pyrimidin]-3'-ol--hydrogen bromide (1/2), RefChem:381212
| Molecular Formula | C22H35Br2N3O3S |
|---|---|
| Molecular Weight | 579.08 g/mol |
| LogP | 4.3054 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 579.0766 |
| Heavy Atoms | 31 |
| Complexity | 774.36804 |
Chemical Identifiers
| CAS Number | 52419-67-7 |
|---|---|
| SMILES | CCCCN1CCC2(CC1)CN=C3N(C2)C(CS3)(C4=C(C=CC(=C4)OC)OC)O.Br.Br |
Product Overview
RefChem:381212 (CAS 52419-67-7), with molecular formula C22H35Br2N3O3S and molecular weight 579.08 g/mol. IUPAC: 1'-butyl-3-(2,5-dimethoxyphenyl)spiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol;dihydrobromide.
Chemical Property Profile of RefChem:381212
Property Insights of RefChem:381212
The XLogP value of 4.3054 indicates that RefChem:381212 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, RefChem:381212 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:381212 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:381212?
The CAS number of RefChem:381212 is 52419-67-7.
What is the molecular formula of RefChem:381212?
The molecular formula of RefChem:381212 is C22H35Br2N3O3S.
What is the molecular weight of RefChem:381212?
The molecular weight of RefChem:381212 is 579.08 g/mol.
Where can I buy RefChem:381212?
You can request a quote for RefChem:381212 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:381212?
Yes, KEHONG BIO provides custom synthesis services for RefChem:381212 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.