1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-
TL;DR: 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- (CAS 50836-28-7) is a chemical compound with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(diethylamino)ethyl]-3-(2-methyl-1,3-benzodioxol-2-yl)propanamide
Also Known As: N-(2-Diethylaminoethyl)-2-methyl-1,3-benzodioxole-2-propionamide, 1,3-BENZODIOXOLE-2-PROPIONAMIDE, N-(2-DIETHYLAMINOETHYL)-2-METHYL-, n-2-methyl-1,3-benzodioxole-2-propionamide, N- -2-methyl-1,3-benzodioxole-2-propionamide, N-[2-(diethylamino)ethyl]-3-(2-methyl-2H-1,3-benzodioxol-2-yl)propanamide
| Molecular Formula | C17H26N2O3 |
|---|---|
| Molecular Weight | 306.19 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 306.19434 |
| Heavy Atoms | 22 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 50836-28-7 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)CCC1(OC2=CC=CC=C2O1)C |
| InChIKey | UXWHRMXLWAPSPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- (CAS 50836-28-7), with molecular formula C17H26N2O3 and molecular weight 306.19 g/mol. IUPAC: N-[2-(diethylamino)ethyl]-3-(2-methyl-1,3-benzodioxol-2-yl)propanamide.
Chemical Property Profile of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-
Property Insights of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-. With a topological polar surface area (TPSA) of 50.8 Ų, 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- has 1 hydrogen bond donor(s) and 4 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 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-?
The CAS number of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- is 50836-28-7.
What is the molecular formula of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-?
The molecular formula of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- is C17H26N2O3.
What is the molecular weight of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-?
The molecular weight of 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- is 306.19 g/mol.
Where can I buy 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-?
You can request a quote for 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxole-2-propionamide, N-(2-diethylaminoethyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.