AB00431325-09
TL;DR: AB00431325-09 (CAS 898358-97-9) is a chemical compound with molecular formula C17H17N7OS3 and molecular weight 431.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[[5-(1H-indol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AB00431325-09, F0653-0082, N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-{[5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((5-(1H-indol-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)acetamide, N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[(5-indol-3-ylidene-4-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C17H17N7OS3 |
|---|---|
| Molecular Weight | 431.07 g/mol |
| LogP | 3.6577 |
| Topological Polar Surface Area | 101.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.06567 |
| Heavy Atoms | 28 |
| Complexity | 1117.0646 |
Chemical Identifiers
| CAS Number | 898358-97-9 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C)C3=CNC4=CC=CC=C43 |
Product Overview
AB00431325-09 (CAS 898358-97-9), with molecular formula C17H17N7OS3 and molecular weight 431.07 g/mol. IUPAC: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[[5-(1H-indol-3-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00431325-09
Property Insights of AB00431325-09
The XLogP value of 3.6577 indicates that AB00431325-09 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.38 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00431325-09. Following Lipinski's Rule of Five, AB00431325-09 has 2 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 AB00431325-09?
The CAS number of AB00431325-09 is 898358-97-9.
What is the molecular formula of AB00431325-09?
The molecular formula of AB00431325-09 is C17H17N7OS3.
What is the molecular weight of AB00431325-09?
The molecular weight of AB00431325-09 is 431.07 g/mol.
Where can I buy AB00431325-09?
You can request a quote for AB00431325-09 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00431325-09?
Yes, KEHONG BIO provides custom synthesis services for AB00431325-09 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.