AN-329/42828869
TL;DR: AN-329/42828869 (CAS 817570-58-4) is a chemical compound with molecular formula C13H19N3O2S2 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dimethylpropanoylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxamide
Also Known As: AN-329/42828869, 2-({[(2,2-dimethylpropanoyl)amino]carbonothioyl}amino)-4,5-dimethyl-3-thiophenecarboxamide, 2-(2,2-dimethylpropanoylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxamide, 2-({[(2,2-dimethylpropanoyl)amino]carbothioyl}amino)-4,5-dimethyl-3-thiophenecarboxamide, 2-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-4,5-dimethylthiophene-3-carboxamide
| Molecular Formula | C13H19N3O2S2 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 2.32294 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.09186 |
| Heavy Atoms | 20 |
| Complexity | 570.9068 |
Chemical Identifiers
| CAS Number | 817570-58-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)C(C)(C)C)C |
Product Overview
AN-329/42828869 (CAS 817570-58-4), with molecular formula C13H19N3O2S2 and molecular weight 313.09 g/mol. IUPAC: 2-(2,2-dimethylpropanoylcarbamothioylamino)-4,5-dimethylthiophene-3-carboxamide.
Chemical Property Profile of AN-329/42828869
Property Insights of AN-329/42828869
The XLogP value of 2.32294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-329/42828869. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/42828869. Following Lipinski's Rule of Five, AN-329/42828869 has 3 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 AN-329/42828869?
The CAS number of AN-329/42828869 is 817570-58-4.
What is the molecular formula of AN-329/42828869?
The molecular formula of AN-329/42828869 is C13H19N3O2S2.
What is the molecular weight of AN-329/42828869?
The molecular weight of AN-329/42828869 is 313.09 g/mol.
Where can I buy AN-329/42828869?
You can request a quote for AN-329/42828869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/42828869?
Yes, KEHONG BIO provides custom synthesis services for AN-329/42828869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.