BAS 00652842
TL;DR: BAS 00652842 (CAS 328243-06-7) is a chemical compound with molecular formula C21H16Br2N2O2S and molecular weight 517.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[(3,5-dibromo-2-prop-2-enoxyphenyl)methylidene]-6,7-dimethyl-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: BAS 00652842, A1688/0072092, (2E)-2-[(3,5-dibromo-2-prop-2-enoxyphenyl)methylidene]-6,7-dimethyl-[1,3]thiazolo[3,2-a]benzimidazol-1-one, 2-[2-(allyloxy)-3,5-dibromobenzylidene]-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, (2E)-2-[3,5-dibromo-2-(prop-2-en-1-yloxy)benzylidene]-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
| Molecular Formula | C21H16Br2N2O2S |
|---|---|
| Molecular Weight | 517.93 g/mol |
| LogP | 5.16354 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 517.92993 |
| Heavy Atoms | 28 |
| Complexity | 1354.9822 |
Chemical Identifiers
| CAS Number | 328243-06-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N3C(=O)/C(=C\C4=C(C(=CC(=C4)Br)Br)OCC=C)/SC3=N2 |
Product Overview
BAS 00652842 (CAS 328243-06-7), with molecular formula C21H16Br2N2O2S and molecular weight 517.93 g/mol. IUPAC: (2E)-2-[(3,5-dibromo-2-prop-2-enoxyphenyl)methylidene]-6,7-dimethyl-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of BAS 00652842
Property Insights of BAS 00652842
The XLogP value of 5.16354 indicates that BAS 00652842 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.6 Ų, BAS 00652842 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00652842 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 BAS 00652842?
The CAS number of BAS 00652842 is 328243-06-7.
What is the molecular formula of BAS 00652842?
The molecular formula of BAS 00652842 is C21H16Br2N2O2S.
What is the molecular weight of BAS 00652842?
The molecular weight of BAS 00652842 is 517.93 g/mol.
Where can I buy BAS 00652842?
You can request a quote for BAS 00652842 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00652842?
Yes, KEHONG BIO provides custom synthesis services for BAS 00652842 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.