3-Methylthienyl-carbonyl-JNJ-7706621
TL;DR: 3-Methylthienyl-carbonyl-JNJ-7706621 (CAS 443798-09-2) is a chemical compound with molecular formula C14H14N6O3S2 and molecular weight 378.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[5-amino-1-(3-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide
Also Known As: 3-Methylthienyl-carbonyl-JNJ-7706621, 1-Acyl-1H-[1,2,4]triazole-3,5-diamine Analogue 3f, 4-[[5-amino-1-(3-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide, 4-((5-Amino-1-(3-methylthiophene-2-carbonyl)-1H-1,2,4-triazol-3-yl)amino)benzenesulfonamide, 4-({5-amino-1-[(3-methylthiophen-2-yl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzene-1-sulfonamide
| Molecular Formula | C14H14N6O3S2 |
|---|---|
| Molecular Weight | 378.06 g/mol |
| LogP | 1.30972 |
| Topological Polar Surface Area | 145.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.0569 |
| Heavy Atoms | 25 |
| Complexity | 1036.964 |
Chemical Identifiers
| CAS Number | 443798-09-2 |
|---|---|
| SMILES | CC1=C(SC=C1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N |
Product Overview
3-Methylthienyl-carbonyl-JNJ-7706621 (CAS 443798-09-2), with molecular formula C14H14N6O3S2 and molecular weight 378.06 g/mol. IUPAC: 4-[[5-amino-1-(3-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide.
Chemical Property Profile of 3-Methylthienyl-carbonyl-JNJ-7706621
Property Insights of 3-Methylthienyl-carbonyl-JNJ-7706621
The XLogP value of 1.30972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylthienyl-carbonyl-JNJ-7706621. The TPSA of 145.99 Ų indicates high polarity, suggesting 3-Methylthienyl-carbonyl-JNJ-7706621 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Methylthienyl-carbonyl-JNJ-7706621 has 3 hydrogen bond donor(s) and 8 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 3-Methylthienyl-carbonyl-JNJ-7706621?
The CAS number of 3-Methylthienyl-carbonyl-JNJ-7706621 is 443798-09-2.
What is the molecular formula of 3-Methylthienyl-carbonyl-JNJ-7706621?
The molecular formula of 3-Methylthienyl-carbonyl-JNJ-7706621 is C14H14N6O3S2.
What is the molecular weight of 3-Methylthienyl-carbonyl-JNJ-7706621?
The molecular weight of 3-Methylthienyl-carbonyl-JNJ-7706621 is 378.06 g/mol.
Where can I buy 3-Methylthienyl-carbonyl-JNJ-7706621?
You can request a quote for 3-Methylthienyl-carbonyl-JNJ-7706621 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylthienyl-carbonyl-JNJ-7706621?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylthienyl-carbonyl-JNJ-7706621 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.