RefChem:283790
TL;DR: RefChem:283790 (CAS 108659-77-4) is a chemical compound with molecular formula C23H15Br2N3O4S2 and molecular weight 618.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfonylmethyl)-6,8-dibromo-3-(2-methoxyphenyl)quinazolin-4-one
Also Known As: 2-((2-Benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-methoxyphenyl)-4(3H)-quinazolinone, 4(3H)-Quinazolinone, 2-((2-benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-methoxyphenyl)-, 2-(1,3-benzothiazol-2-ylsulfonylmethyl)-6,8-dibromo-3-(2-methoxyphenyl)quinazolin-4-one, 2-[(1,3-benzothiazol-2-ylsulfonyl)methyl]-6,8-dibromo-3-(2-methoxyphenyl)quinazolin-4(3h)-one, 2-[(1,3-Benzothiazole-2-sulfonyl)methyl]-6,8-dibromo-3-(2-methoxyphenyl)quinazolin-4(3H)-one
| Molecular Formula | C23H15Br2N3O4S2 |
|---|---|
| Molecular Weight | 618.89 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 620.885 |
| Heavy Atoms | 34 |
| Complexity | 914.0 |
Chemical Identifiers
| CAS Number | 108659-77-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3Br)Br)CS(=O)(=O)C4=NC5=CC=CC=C5S4 |
| InChIKey | GVOSZPAPORTVLO-UHFFFAOYSA-N |
Product Overview
RefChem:283790 (CAS 108659-77-4), with molecular formula C23H15Br2N3O4S2 and molecular weight 618.89 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfonylmethyl)-6,8-dibromo-3-(2-methoxyphenyl)quinazolin-4-one.
Chemical Property Profile of RefChem:283790
Property Insights of RefChem:283790
The XLogP value of 5.5 indicates that RefChem:283790 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:283790. Following Lipinski's Rule of Five, RefChem:283790 has 0 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:283790?
The CAS number of RefChem:283790 is 108659-77-4.
What is the molecular formula of RefChem:283790?
The molecular formula of RefChem:283790 is C23H15Br2N3O4S2.
What is the molecular weight of RefChem:283790?
The molecular weight of RefChem:283790 is 618.89 g/mol.
Where can I buy RefChem:283790?
You can request a quote for RefChem:283790 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:283790?
Yes, KEHONG BIO provides custom synthesis services for RefChem:283790 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.