RefChem:381217
TL;DR: RefChem:381217 (CAS 52419-69-9) is a chemical compound with molecular formula C27H31Br2N3OS and molecular weight 603.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-benzyl-3-naphthalen-2-ylspiro[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-naphthalenyl)-1-(phenylmethyl)-, dihydrobromide, 1'-benzyl-3-naphthalen-2-ylspiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol dihydrobromide, 1-Benzyl-3'-(naphthalen-2-yl)-2',3'-dihydro-5'H,7'H-spiro[piperidine-4,6'-[1,3]thiazolo[3,2-a]pyrimidin]-3'-ol--hydrogen bromide (1/2), Spiro[piperidine-4,6'(7'H)-[5H]thiazolo[3,2-a]pyrimidin]-3'-ol,2',3'-dihydro-3'-(2-naphthalenyl)-1-(phenylmethyl)-, hydrobromide (1:2), Spiro[piperidine-4,6'(7'h)-[5h]thiazolo[3,2-a]pyrimidin]-3'-ol,2',3'-dihydro-3'-(2-naphthalenyl)-1-(phenylmethyl)-,hydrobromide(1:2)
| Molecular Formula | C27H31Br2N3OS |
|---|---|
| Molecular Weight | 603.06 g/mol |
| LogP | 5.8415 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 603.0555 |
| Heavy Atoms | 34 |
| Complexity | 1166.7637 |
Chemical Identifiers
| CAS Number | 52419-69-9 |
|---|---|
| SMILES | C1CN(CCC12CN=C3N(C2)C(CS3)(C4=CC5=CC=CC=C5C=C4)O)CC6=CC=CC=C6.Br.Br |
Product Overview
RefChem:381217 (CAS 52419-69-9), with molecular formula C27H31Br2N3OS and molecular weight 603.06 g/mol. IUPAC: 1'-benzyl-3-naphthalen-2-ylspiro[5,7-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6,4'-piperidine]-3-ol;dihydrobromide.
Chemical Property Profile of RefChem:381217
Property Insights of RefChem:381217
The XLogP value of 5.8415 indicates that RefChem:381217 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.07 Ų, RefChem:381217 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:381217 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:381217?
The CAS number of RefChem:381217 is 52419-69-9.
What is the molecular formula of RefChem:381217?
The molecular formula of RefChem:381217 is C27H31Br2N3OS.
What is the molecular weight of RefChem:381217?
The molecular weight of RefChem:381217 is 603.06 g/mol.
Where can I buy RefChem:381217?
You can request a quote for RefChem:381217 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:381217?
Yes, KEHONG BIO provides custom synthesis services for RefChem:381217 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.