![N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide structure](/static/products/5774/5774-38-9.webp)
N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide
TL;DR: N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide (CAS 5774-38-9) is a chemical compound with molecular formula C24H22N2O4S and molecular weight 434.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide
Also Known As: N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide, N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide
| Molecular Formula | C24H22N2O4S |
|---|---|
| Molecular Weight | 434.13 g/mol |
| LogP | 4.18094 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.13004 |
| Heavy Atoms | 31 |
| Complexity | 1152.3909 |
Chemical Identifiers
| CAS Number | 5774-38-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)C |
Product Overview
N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide (CAS 5774-38-9), with molecular formula C24H22N2O4S and molecular weight 434.13 g/mol. IUPAC: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide.
Chemical Property Profile of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide
Property Insights of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide
The XLogP value of 4.18094 indicates that N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide. Following Lipinski's Rule of Five, N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide has 2 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 N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide?
The CAS number of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide is 5774-38-9.
What is the molecular formula of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide?
The molecular formula of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide is C24H22N2O4S.
What is the molecular weight of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide?
The molecular weight of N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide is 434.13 g/mol.
Where can I buy N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide?
You can request a quote for N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-{[(2H-1,3-Benzodioxol-5-yl)methyl]amino}-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.