AN-988/40788188
TL;DR: AN-988/40788188 (CAS 489396-31-8) is a chemical compound with molecular formula C17H20N6O2S4 and molecular weight 468.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-[[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butylacetamide
Also Known As: AN-988/40788188, 2-(5-Amino-[1,3,4]thiadiazol-2-ylsulfanyl)-N-(2-butylcarbamoylmethylsulfanyl-benzothiazol-6-yl)-acetamide, 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide, 2-[[6-[[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butylacetamide, 2-((5-amino-1,3,4-thiadiazol-2-yl)thio)-N-(2-((2-(butylamino)-2-oxoethyl)thio)benzo[d]thiazol-6-yl)acetamide
| Molecular Formula | C17H20N6O2S4 |
|---|---|
| Molecular Weight | 468.05 g/mol |
| LogP | 3.4692 |
| Topological Polar Surface Area | 122.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 468.05307 |
| Heavy Atoms | 29 |
| Complexity | 989.37714 |
Chemical Identifiers
| CAS Number | 489396-31-8 |
|---|---|
| SMILES | CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=C(S3)N |
Product Overview
AN-988/40788188 (CAS 489396-31-8), with molecular formula C17H20N6O2S4 and molecular weight 468.05 g/mol. IUPAC: 2-[[6-[[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-butylacetamide.
Chemical Property Profile of AN-988/40788188
Property Insights of AN-988/40788188
The XLogP value of 3.4692 indicates that AN-988/40788188 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-988/40788188. Following Lipinski's Rule of Five, AN-988/40788188 has 3 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 AN-988/40788188?
The CAS number of AN-988/40788188 is 489396-31-8.
What is the molecular formula of AN-988/40788188?
The molecular formula of AN-988/40788188 is C17H20N6O2S4.
What is the molecular weight of AN-988/40788188?
The molecular weight of AN-988/40788188 is 468.05 g/mol.
Where can I buy AN-988/40788188?
You can request a quote for AN-988/40788188 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/40788188?
Yes, KEHONG BIO provides custom synthesis services for AN-988/40788188 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.