![[2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate structure](/static/products/3916/391605-73-5.webp)
[2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate
TL;DR: [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate (CAS 391605-73-5) is a chemical compound with molecular formula C19H19NO5 and molecular weight 341.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate
Also Known As: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate, 2-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-2-oxoethyl 2,3-dimethylbenzoate
| Molecular Formula | C19H19NO5 |
|---|---|
| Molecular Weight | 341.13 g/mol |
| LogP | 2.50534 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.1263 |
| Heavy Atoms | 25 |
| Complexity | 815.4569 |
Chemical Identifiers
| CAS Number | 391605-73-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)OCC(=O)NCC2=CC3=C(C=C2)OCO3)C |
Product Overview
[2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate (CAS 391605-73-5), with molecular formula C19H19NO5 and molecular weight 341.13 g/mol. IUPAC: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate.
Chemical Property Profile of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate
Property Insights of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate
The XLogP value of 2.50534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate. Following Lipinski's Rule of Five, [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate has 1 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 [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate?
The CAS number of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate is 391605-73-5.
What is the molecular formula of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate?
The molecular formula of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate is C19H19NO5.
What is the molecular weight of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate?
The molecular weight of [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate is 341.13 g/mol.
Where can I buy [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate?
You can request a quote for [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(1,3-Benzodioxol-5-ylmethylamino)-2-oxoethyl] 2,3-dimethylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.