1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-
TL;DR: 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- (CAS 64179-22-2) is a chemical compound with molecular formula C21H23NO4 and molecular weight 353.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2,2-dipropyl-1,3-benzodioxol-5-yl)amino]-3H-2-benzofuran-1-one
Also Known As: 3-((2,2-Dipropyl-1,3-benzodioxol-5-yl)amino)-1(3H)-isobenzofuranone, 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-, 3-[(2,2-dipropyl-1,3-benzodioxol-5-yl)amino]-3H-2-benzofuran-1-one, 3-[(2,2-Dipropyl-2H-1,3-benzodioxol-5-yl)amino]-2-benzofuran-1(3H)-one, RefChem:211686
| Molecular Formula | C21H23NO4 |
|---|---|
| Molecular Weight | 353.16 g/mol |
| LogP | 5.0354 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.16272 |
| Heavy Atoms | 26 |
| Complexity | 826.5108 |
Chemical Identifiers
| CAS Number | 64179-22-2 |
|---|---|
| SMILES | CCCC1(OC2=C(O1)C=C(C=C2)NC3C4=CC=CC=C4C(=O)O3)CCC |
Product Overview
1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- (CAS 64179-22-2), with molecular formula C21H23NO4 and molecular weight 353.16 g/mol. IUPAC: 3-[(2,2-dipropyl-1,3-benzodioxol-5-yl)amino]-3H-2-benzofuran-1-one.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-
Property Insights of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-
The XLogP value of 5.0354 indicates that 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-?
The CAS number of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- is 64179-22-2.
What is the molecular formula of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-?
The molecular formula of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- is C21H23NO4.
What is the molecular weight of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-?
The molecular weight of 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- is 353.16 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-?
You can request a quote for 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 3-((2,2-dipropyl-1,3-benzodioxol-5-yl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.