RefChem:381213
TL;DR: RefChem:381213 (CAS 52419-70-2) is a chemical compound with molecular formula C25H33Br2N3O3S and molecular weight 613.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-benzyl-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-3'-(2,5-dimethoxyphenyl)-1-(phenylmethyl)-, dihydrobromide, 1'-benzyl-3-(2,5-dimethoxyphenyl)spiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol dihydrobromide, 1-Benzyl-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:381213
| Molecular Formula | C25H33Br2N3O3S |
|---|---|
| Molecular Weight | 613.06 g/mol |
| LogP | 4.7055 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 613.0609 |
| Heavy Atoms | 34 |
| Complexity | 1002.15533 |
Chemical Identifiers
| CAS Number | 52419-70-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)C2(CSC3=NCC4(CCN(CC4)CC5=CC=CC=C5)CN32)O.Br.Br |
Product Overview
RefChem:381213 (CAS 52419-70-2), with molecular formula C25H33Br2N3O3S and molecular weight 613.06 g/mol. IUPAC: 1'-benzyl-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:381213
Property Insights of RefChem:381213
The XLogP value of 4.7055 indicates that RefChem:381213 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:381213 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:381213 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:381213?
The CAS number of RefChem:381213 is 52419-70-2.
What is the molecular formula of RefChem:381213?
The molecular formula of RefChem:381213 is C25H33Br2N3O3S.
What is the molecular weight of RefChem:381213?
The molecular weight of RefChem:381213 is 613.06 g/mol.
Where can I buy RefChem:381213?
You can request a quote for RefChem:381213 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:381213?
Yes, KEHONG BIO provides custom synthesis services for RefChem:381213 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.