[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
TL;DR: [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate (CAS 748024-01-3) is a chemical compound with molecular formula C21H23NO8 and molecular weight 417.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
Also Known As: [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate|1-[(2,3-Dihydro-1,4-benzodioxin-6-yl)amino]-1-oxopropan-2-yl 3,4,5-trimethoxybenzoate|MLS002249767|SMR001317193
| Molecular Formula | C21H23NO8 |
|---|---|
| Molecular Weight | 417.14 g/mol |
| LogP | 2.6676 |
| Topological Polar Surface Area | 101.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.14236 |
| Heavy Atoms | 30 |
| Complexity | 917.5939 |
Chemical Identifiers
| CAS Number | 748024-01-3 |
|---|---|
| SMILES | CC(C(=O)NC1=CC2=C(C=C1)OCCO2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC |
Product Overview
[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate (CAS 748024-01-3), with molecular formula C21H23NO8 and molecular weight 417.14 g/mol. IUPAC: [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
Property Insights of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate
The XLogP value of 2.6676 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate. The TPSA of 101.55 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate has 1 hydrogen bond donor(s) and 8 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 [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The CAS number of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is 748024-01-3.
What is the molecular formula of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The molecular formula of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is C21H23NO8.
What is the molecular weight of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
The molecular weight of [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate is 417.14 g/mol.
Where can I buy [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
You can request a quote for [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.