BAS 00384504
TL;DR: BAS 00384504 (CAS 331659-91-7) is a chemical compound with molecular formula C17H8BrCl2NO4 and molecular weight 438.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5-one
Also Known As: BAS 00384504, (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5(4H)-one, (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5-one, (Z)-4-((6-bromobenzo[d][1,3]dioxol-5-yl)methylene)-2-(2,4-dichlorophenyl)oxazol-5(4H)-one
| Molecular Formula | C17H8BrCl2NO4 |
|---|---|
| Molecular Weight | 438.90 g/mol |
| LogP | 4.8291 |
| Topological Polar Surface Area | 57.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 438.90137 |
| Heavy Atoms | 25 |
| Complexity | 971.3605 |
Chemical Identifiers
| CAS Number | 331659-91-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)/C=C\3/C(=O)OC(=N3)C4=C(C=C(C=C4)Cl)Cl)Br |
Product Overview
BAS 00384504 (CAS 331659-91-7), with molecular formula C17H8BrCl2NO4 and molecular weight 438.90 g/mol. IUPAC: (4Z)-4-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-2-(2,4-dichlorophenyl)-1,3-oxazol-5-one.
Chemical Property Profile of BAS 00384504
Property Insights of BAS 00384504
The XLogP value of 4.8291 indicates that BAS 00384504 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.12 Ų, BAS 00384504 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00384504 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00384504?
The CAS number of BAS 00384504 is 331659-91-7.
What is the molecular formula of BAS 00384504?
The molecular formula of BAS 00384504 is C17H8BrCl2NO4.
What is the molecular weight of BAS 00384504?
The molecular weight of BAS 00384504 is 438.90 g/mol.
Where can I buy BAS 00384504?
You can request a quote for BAS 00384504 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00384504?
Yes, KEHONG BIO provides custom synthesis services for BAS 00384504 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.