5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide
TL;DR: 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide (CAS 354547-87-8) is a chemical compound with molecular formula C19H21N3O5S and molecular weight 403.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide
Also Known As: 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide, 5-[(1,3-BENZODIOXOL-5-YLCARBONYL)AMINO]-N~2~,N~2~-DIETHYL-3-METHYL-2,4-THIOPHENEDICARBOXAMIDE, 5-[(1,3-benzodioxol-5-ylcarbonyl)amino]-N~2~,N~2~-diethyl-3-methylthiophene-2,4-dicarboxamide
| Molecular Formula | C19H21N3O5S |
|---|---|
| Molecular Weight | 403.12 g/mol |
| LogP | 2.61842 |
| Topological Polar Surface Area | 110.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.12018 |
| Heavy Atoms | 28 |
| Complexity | 949.286 |
Chemical Identifiers
| CAS Number | 354547-87-8 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)N)C |
Product Overview
5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide (CAS 354547-87-8), with molecular formula C19H21N3O5S and molecular weight 403.12 g/mol. IUPAC: 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide.
Chemical Property Profile of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide
Property Insights of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide
The XLogP value of 2.61842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide. The TPSA of 110.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide. Following Lipinski's Rule of Five, 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide has 2 hydrogen bond donor(s) and 6 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 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide?
The CAS number of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide is 354547-87-8.
What is the molecular formula of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide?
The molecular formula of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide is C19H21N3O5S.
What is the molecular weight of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide?
The molecular weight of 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide is 403.12 g/mol.
Where can I buy 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide?
You can request a quote for 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-(1,3-benzodioxole-5-carbonylamino)-2-N,2-N-diethyl-3-methylthiophene-2,4-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.