BAS 12409818
TL;DR: BAS 12409818 (CAS 876895-47-5) is a chemical compound with molecular formula C12H14N4O3S4 and molecular weight 389.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-2-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-1,3-thiazole-5-carboxylate
Also Known As: BAS 12409818, SDCCGSBI-0135596.P001, ethyl 4-methyl-2-(2-((3-(methylthio)-1,2,4-thiadiazol-5-yl)thio)acetamido)thiazole-5-carboxylate, ETHYL 4-METHYL-2-(2-{[3-(METHYLSULFANYL)-1,2,4-THIADIAZOL-5-YL]SULFANYL}ACETAMIDO)-1,3-THIAZOLE-5-CARBOXYLATE, ethyl 4-methyl-2-[({[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]sulfanyl}acetyl)amino]-1,3-thiazole-5-carboxylate
| Molecular Formula | C12H14N4O3S4 |
|---|---|
| Molecular Weight | 389.99 g/mol |
| LogP | 2.93242 |
| Topological Polar Surface Area | 94.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.99487 |
| Heavy Atoms | 23 |
| Complexity | 700.2922 |
Chemical Identifiers
| CAS Number | 876895-47-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC(=NS2)SC)C |
Product Overview
BAS 12409818 (CAS 876895-47-5), with molecular formula C12H14N4O3S4 and molecular weight 389.99 g/mol. IUPAC: ethyl 4-methyl-2-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]-1,3-thiazole-5-carboxylate.
Chemical Property Profile of BAS 12409818
Property Insights of BAS 12409818
The XLogP value of 2.93242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12409818. The TPSA of 94.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12409818. Following Lipinski's Rule of Five, BAS 12409818 has 1 hydrogen bond donor(s) and 10 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 BAS 12409818?
The CAS number of BAS 12409818 is 876895-47-5.
What is the molecular formula of BAS 12409818?
The molecular formula of BAS 12409818 is C12H14N4O3S4.
What is the molecular weight of BAS 12409818?
The molecular weight of BAS 12409818 is 389.99 g/mol.
Where can I buy BAS 12409818?
You can request a quote for BAS 12409818 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12409818?
Yes, KEHONG BIO provides custom synthesis services for BAS 12409818 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.