RefChem:283791
TL;DR: RefChem:283791 (CAS 108635-41-2) is a chemical compound with molecular formula C22H12Br2ClN3OS2 and molecular weight 590.8477 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,8-dibromo-3-(2-chlorophenyl)quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 2-((2-benzothiazolylthio)methyl)-6,8-dibromo-3-(2-chlorophenyl)-, 2-((2-Benzothiazolylthio)methyl)-6,8-dibromo-3-(2-chlorophenyl)-4(3H)-quinazolinone, 2-(1,3-benzothiazol-2-ylsulfanylmethyl)-6,8-dibromo-3-(2-chlorophenyl)quinazolin-4-one, 4(3H)-Quinazolinone, 2-((benzothiazolylthio)methyl)-6,8-dibromo-3-(2-chlorophenyl)-, 2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-6,8-dibromo-3-(2-chlorophenyl)quinazolin-4(3h)-one
Technical Specifications
| Molecular Formula | C22H12Br2ClN3OS2 |
| Molecular Weight | 590.8477 g/mol |
| XLogP | 7.5 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 592.84564 Da |
| Heavy Atoms | 31 |
| Complexity | 716.0 |
| SMILES | C1=CC=C2C(=C1)N=C(S2)SCC3=NC4=C(C=C(C=C4Br)Br)C(=O)N3C5=CC=CC=C5Cl |
| InChIKey | BOTKUNBCIROUNR-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:283791
Property Insights of RefChem:283791
The XLogP value of 7.5 indicates that RefChem:283791 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:283791. Following Lipinski's Rule of Five, RefChem:283791 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:283791?
The CAS number of RefChem:283791 is 108635-41-2.
What is the molecular formula of RefChem:283791?
The molecular formula of RefChem:283791 is C22H12Br2ClN3OS2.
What is the molecular weight of RefChem:283791?
The molecular weight of RefChem:283791 is 590.8477 g/mol.
Where can I buy RefChem:283791?
You can request a quote for RefChem:283791 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:283791?
Yes, CoreyChem provides custom synthesis services for RefChem:283791 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.