A1889/0079358
TL;DR: A1889/0079358 (CAS 296793-06-1) is a chemical compound with molecular formula C21H16N6OS2 and molecular weight 432.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Also Known As: A1889/0079358, 2-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide, 2-[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide, 2-({5-BENZYL-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-(1,3-THIAZOL-2-YL)ACETAMIDE, 2-({5-BENZYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-(1,3-THIAZOL-2-YL)ACETAMIDE
| Molecular Formula | C21H16N6OS2 |
|---|---|
| Molecular Weight | 432.08 g/mol |
| LogP | 4.2151 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.0827 |
| Heavy Atoms | 30 |
| Complexity | 1317.8715 |
Chemical Identifiers
| CAS Number | 296793-06-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2N=C(N=N4)SCC(=O)NC5=NC=CS5 |
Product Overview
A1889/0079358 (CAS 296793-06-1), with molecular formula C21H16N6OS2 and molecular weight 432.08 g/mol. IUPAC: 2-[(5-benzyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of A1889/0079358
Property Insights of A1889/0079358
The XLogP value of 4.2151 indicates that A1889/0079358 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 A1889/0079358. Following Lipinski's Rule of Five, A1889/0079358 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 A1889/0079358?
The CAS number of A1889/0079358 is 296793-06-1.
What is the molecular formula of A1889/0079358?
The molecular formula of A1889/0079358 is C21H16N6OS2.
What is the molecular weight of A1889/0079358?
The molecular weight of A1889/0079358 is 432.08 g/mol.
Where can I buy A1889/0079358?
You can request a quote for A1889/0079358 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1889/0079358?
Yes, KEHONG BIO provides custom synthesis services for A1889/0079358 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.