A3896/0165731
TL;DR: A3896/0165731 (CAS 728883-34-9) is a chemical compound with molecular formula C13H19N5OS2 and molecular weight 325.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: A3896/0165731, 2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide, 2-[(5-ISOBUTYL-4-METHYL-1H-IMIDAZOL-2-YL)SULFANYL]-N-(5-METHYL-1,3,4-THIADIAZOL-2-YL)ACETAMIDE, 2-{[4-methyl-5-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
| Molecular Formula | C13H19N5OS2 |
|---|---|
| Molecular Weight | 325.10 g/mol |
| LogP | 2.80734 |
| Topological Polar Surface Area | 83.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.1031 |
| Heavy Atoms | 21 |
| Complexity | 619.8602 |
Chemical Identifiers
| CAS Number | 728883-34-9 |
|---|---|
| SMILES | CC1=C(N=C(N1)SCC(=O)NC2=NN=C(S2)C)CC(C)C |
Product Overview
A3896/0165731 (CAS 728883-34-9), with molecular formula C13H19N5OS2 and molecular weight 325.10 g/mol. IUPAC: 2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of A3896/0165731
Property Insights of A3896/0165731
The XLogP value of 2.80734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3896/0165731. The TPSA of 83.56 Ų falls within the moderate polarity range, balancing permeability and solubility for A3896/0165731. Following Lipinski's Rule of Five, A3896/0165731 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 A3896/0165731?
The CAS number of A3896/0165731 is 728883-34-9.
What is the molecular formula of A3896/0165731?
The molecular formula of A3896/0165731 is C13H19N5OS2.
What is the molecular weight of A3896/0165731?
The molecular weight of A3896/0165731 is 325.10 g/mol.
Where can I buy A3896/0165731?
You can request a quote for A3896/0165731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3896/0165731?
Yes, KEHONG BIO provides custom synthesis services for A3896/0165731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.