SYNUCLEOZID-2.0
TL;DR: SYNUCLEOZID-2.0 (CAS 613226-91-8) is a chemical compound with molecular formula C22H16BrN7OS and molecular weight 505.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1H-indazol-6-yl)acetamide
Also Known As: SYNUCLEOZID-2.0, 2-((4-(4-Bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(1H-indazol-6-yl)acetamide, 2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1H-indazol-6-yl)acetamide, 2-{[4-(4-bromophenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1H-indazol-6-yl)acetamide, 2-{[4-(4-bromophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1H-indazol-6-yl)acetamide
| Molecular Formula | C22H16BrN7OS |
|---|---|
| Molecular Weight | 505.03 g/mol |
| LogP | 4.6989 |
| Topological Polar Surface Area | 101.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.03204 |
| Heavy Atoms | 32 |
| Complexity | 1382.7235 |
Chemical Identifiers
| CAS Number | 613226-91-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)C=NN4)C5=CC=NC=C5)Br |
Product Overview
SYNUCLEOZID-2.0 (CAS 613226-91-8), with molecular formula C22H16BrN7OS and molecular weight 505.03 g/mol. IUPAC: 2-[[4-(4-bromophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(1H-indazol-6-yl)acetamide.
Chemical Property Profile of SYNUCLEOZID-2.0
Property Insights of SYNUCLEOZID-2.0
The XLogP value of 4.6989 indicates that SYNUCLEOZID-2.0 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 SYNUCLEOZID-2.0. Following Lipinski's Rule of Five, SYNUCLEOZID-2.0 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SYNUCLEOZID-2.0?
The CAS number of SYNUCLEOZID-2.0 is 613226-91-8.
What is the molecular formula of SYNUCLEOZID-2.0?
The molecular formula of SYNUCLEOZID-2.0 is C22H16BrN7OS.
What is the molecular weight of SYNUCLEOZID-2.0?
The molecular weight of SYNUCLEOZID-2.0 is 505.03 g/mol.
Where can I buy SYNUCLEOZID-2.0?
You can request a quote for SYNUCLEOZID-2.0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SYNUCLEOZID-2.0?
Yes, KEHONG BIO provides custom synthesis services for SYNUCLEOZID-2.0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.