RefChem:284212
TL;DR: RefChem:284212 (CAS 108659-79-6) is a chemical compound with molecular formula C19H17Br2ClN2O3S and molecular weight 545.90155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,8-dibromo-2-(tert-butylsulfonylmethyl)-3-(2-chlorophenyl)quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6,8-dibromo-3-(2-chlorophenyl)-2-(((1,1-dimethylethyl)sulfonyl)methyl)-, 6,8-Dibromo-3-(2-chlorophenyl)-2-(((1,1-dimethylethyl)sulfonyl)methyl)-4(3H)-quinazolinone, 6,8-dibromo-2-(tert-butylsulfonylmethyl)-3-(2-chlorophenyl)quinazolin-4-one, 6,8-dibromo-2-[(tert-butylsulfonyl)methyl]-3-(2-chlorophenyl)quinazolin-4(3h)-one, 6,8-Dibromo-3-(2-chlorophenyl)-2-[(2-methylpropane-2-sulfonyl)methyl]quinazolin-4(3H)-one
Technical Specifications
| Molecular Formula | C19H17Br2ClN2O3S |
| Molecular Weight | 545.90155 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 75.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 547.8995 Da |
| Heavy Atoms | 28 |
| Complexity | 747.0 |
| SMILES | CC(C)(C)S(=O)(=O)CC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1C3=CC=CC=C3Cl |
| InChIKey | XXYRAKCUPMMNFO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:284212
Property Insights of RefChem:284212
The XLogP value of 4.8 indicates that RefChem:284212 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:284212. Following Lipinski's Rule of Five, RefChem:284212 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:284212?
The CAS number of RefChem:284212 is 108659-79-6.
What is the molecular formula of RefChem:284212?
The molecular formula of RefChem:284212 is C19H17Br2ClN2O3S.
What is the molecular weight of RefChem:284212?
The molecular weight of RefChem:284212 is 545.90155 g/mol.
Where can I buy RefChem:284212?
You can request a quote for RefChem:284212 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:284212?
Yes, CoreyChem provides custom synthesis services for RefChem:284212 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.