Sirt2-IN-9
TL;DR: Sirt2-IN-9 (CAS 522650-91-5) is a chemical compound with molecular formula C21H22N6OS2 and molecular weight 438.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Also Known As: 2-((5-Propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio)-N-(4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)acetamide, 2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide, 2-({5-PROPYL-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-(4,5,6,7-TETRAHYDRO-1,3-BENZOTHIAZOL-2-YL)ACETAMIDE, 2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide, 2-[(5-PROPYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL)SULFANYL]-N~1~-(4,5,6,7-TETRAHYDRO-1,3-BENZOTHIAZOL-2-YL)ACETAMIDE
| Molecular Formula | C21H22N6OS2 |
|---|---|
| Molecular Weight | 438.13 g/mol |
| LogP | 4.4556 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.12964 |
| Heavy Atoms | 30 |
| Complexity | 1207.6688 |
Chemical Identifiers
| CAS Number | 522650-91-5 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=NC5=C(S4)CCCC5 |
Product Overview
Sirt2-IN-9 (CAS 522650-91-5), with molecular formula C21H22N6OS2 and molecular weight 438.13 g/mol. IUPAC: 2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of Sirt2-IN-9
Property Insights of Sirt2-IN-9
The XLogP value of 4.4556 indicates that Sirt2-IN-9 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Sirt2-IN-9. Following Lipinski's Rule of Five, Sirt2-IN-9 has 1 hydrogen bond donor(s) and 7 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 Sirt2-IN-9?
The CAS number of Sirt2-IN-9 is 522650-91-5.
What is the molecular formula of Sirt2-IN-9?
The molecular formula of Sirt2-IN-9 is C21H22N6OS2.
What is the molecular weight of Sirt2-IN-9?
The molecular weight of Sirt2-IN-9 is 438.13 g/mol.
Where can I buy Sirt2-IN-9?
You can request a quote for Sirt2-IN-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sirt2-IN-9?
Yes, KEHONG BIO provides custom synthesis services for Sirt2-IN-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.