BAS 00384410
TL;DR: BAS 00384410 (CAS 331659-48-4) is a chemical compound with molecular formula C25H27NO5 and molecular weight 421.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-(1,3-benzodioxol-5-yl)-4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-oxazol-5-one
Also Known As: BAS 00384410, (4E)-2-(1,3-benzodioxol-5-yl)-4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-oxazol-5-one, 2-(1,3-benzodioxol-5-yl)-4-(3,5-ditert-butyl-4-hydroxybenzylidene)-1,3-oxazol-5(4H)-one
| Molecular Formula | C25H27NO5 |
|---|---|
| Molecular Weight | 421.19 g/mol |
| LogP | 5.0604 |
| Topological Polar Surface Area | 77.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 421.18893 |
| Heavy Atoms | 31 |
| Complexity | 1094.572 |
Chemical Identifiers
| CAS Number | 331659-48-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/2\C(=O)OC(=N2)C3=CC4=C(C=C3)OCO4 |
Product Overview
BAS 00384410 (CAS 331659-48-4), with molecular formula C25H27NO5 and molecular weight 421.19 g/mol. IUPAC: (4E)-2-(1,3-benzodioxol-5-yl)-4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-oxazol-5-one.
Chemical Property Profile of BAS 00384410
Property Insights of BAS 00384410
The XLogP value of 5.0604 indicates that BAS 00384410 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.35 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00384410. Following Lipinski's Rule of Five, BAS 00384410 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00384410?
The CAS number of BAS 00384410 is 331659-48-4.
What is the molecular formula of BAS 00384410?
The molecular formula of BAS 00384410 is C25H27NO5.
What is the molecular weight of BAS 00384410?
The molecular weight of BAS 00384410 is 421.19 g/mol.
Where can I buy BAS 00384410?
You can request a quote for BAS 00384410 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00384410?
Yes, KEHONG BIO provides custom synthesis services for BAS 00384410 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.