5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide
TL;DR: 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide (CAS 830339-29-2) is a chemical compound with molecular formula C22H20N4O3S and molecular weight 420.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide
Also Known As: 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide, 5-methyl-N-[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]-4-phenylthiophene-3-carboxamide, (5-methyl-4-phenyl(3-thienyl))-N-(7-morpholin-4-ylbenzo[2,3-c]1,2,5-oxadiazol- 4-yl)carboxamide
| Molecular Formula | C22H20N4O3S |
|---|---|
| Molecular Weight | 420.13 g/mol |
| LogP | 4.34862 |
| Topological Polar Surface Area | 80.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.1256 |
| Heavy Atoms | 30 |
| Complexity | 1195.8021 |
Chemical Identifiers
| CAS Number | 830339-29-2 |
|---|---|
| SMILES | CC1=C(C(=CS1)C(=O)NC2=CC=C(C3=NON=C23)N4CCOCC4)C5=CC=CC=C5 |
Product Overview
5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide (CAS 830339-29-2), with molecular formula C22H20N4O3S and molecular weight 420.13 g/mol. IUPAC: 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide.
Chemical Property Profile of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide
Property Insights of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide
The XLogP value of 4.34862 indicates that 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide. Following Lipinski's Rule of Five, 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide has 1 hydrogen bond donor(s) and 7 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-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide?
The CAS number of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide is 830339-29-2.
What is the molecular formula of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide?
The molecular formula of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide is C22H20N4O3S.
What is the molecular weight of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide?
The molecular weight of 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide is 420.13 g/mol.
Where can I buy 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide?
You can request a quote for 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-methyl-N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-4-phenylthiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.