RefChem:284191
TL;DR: RefChem:284191 (CAS 108635-32-1) is a chemical compound with molecular formula C20H20Br2N2O2S and molecular weight 509.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dibromo-2-(tert-butylsulfanylmethyl)-3-(2-methoxyphenyl)quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6,8-dibromo-2-(((1,1-dimethylethyl)thio)methyl)-3-(2-methoxyphenyl)-, 6,8-Dibromo-2-(((1,1-dimethylethyl)thio)methyl)-3-(2-methoxyphenyl)-4(3H)-quinazolinone, 6,8-dibromo-2-[(tert-butylsulfanyl)methyl]-3-(2-methoxyphenyl)quinazolin-4(3h)-one, 6,8-dibromo-2-(tert-butylsulfanylmethyl)-3-(2-methoxyphenyl)quinazolin-4-one, RefChem:284191
| Molecular Formula | C20H20Br2N2O2S |
|---|---|
| Molecular Weight | 509.96 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 511.95917 |
| Heavy Atoms | 27 |
| Complexity | 581.0 |
Chemical Identifiers
| CAS Number | 108635-32-1 |
|---|---|
| SMILES | CC(C)(C)SCC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1C3=CC=CC=C3OC |
| InChIKey | CISIRSHHFNJTFU-UHFFFAOYSA-N |
Product Overview
RefChem:284191 (CAS 108635-32-1), with molecular formula C20H20Br2N2O2S and molecular weight 509.96 g/mol. IUPAC: 6,8-dibromo-2-(tert-butylsulfanylmethyl)-3-(2-methoxyphenyl)quinazolin-4-one.
Chemical Property Profile of RefChem:284191
Property Insights of RefChem:284191
The XLogP value of 5.5 indicates that RefChem:284191 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284191. Following Lipinski's Rule of Five, RefChem:284191 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:284191?
The CAS number of RefChem:284191 is 108635-32-1.
What is the molecular formula of RefChem:284191?
The molecular formula of RefChem:284191 is C20H20Br2N2O2S.
What is the molecular weight of RefChem:284191?
The molecular weight of RefChem:284191 is 509.96 g/mol.
Where can I buy RefChem:284191?
You can request a quote for RefChem:284191 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284191?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284191 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.