starbld0003442
TL;DR: starbld0003442 (CAS 745068-65-9) is a chemical compound with molecular formula C22H21F2N5OS and molecular weight 441.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyano-3-methylbutan-2-yl)-2-[[4-(2,4-difluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: starbld0003442, N-(2-Cyano-3-methylbutan-2-yl)-2-((4-(2,4-difluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(1-cyano-1,2-dimethylpropyl)-2-{[4-(2,4-difluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-cyano-3-methylbutan-2-yl)-2-[[4-(2,4-difluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H21F2N5OS |
|---|---|
| Molecular Weight | 441.14 g/mol |
| LogP | 4.35908 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.1435 |
| Heavy Atoms | 31 |
| Complexity | 1126.675 |
Chemical Identifiers
| CAS Number | 745068-65-9 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1C2=C(C=C(C=C2)F)F)C3=CC=CC=C3 |
Product Overview
starbld0003442 (CAS 745068-65-9), with molecular formula C22H21F2N5OS and molecular weight 441.14 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-[[4-(2,4-difluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of starbld0003442
Property Insights of starbld0003442
The XLogP value of 4.35908 indicates that starbld0003442 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0003442. Following Lipinski's Rule of Five, starbld0003442 has 1 hydrogen bond donor(s) and 5 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 starbld0003442?
The CAS number of starbld0003442 is 745068-65-9.
What is the molecular formula of starbld0003442?
The molecular formula of starbld0003442 is C22H21F2N5OS.
What is the molecular weight of starbld0003442?
The molecular weight of starbld0003442 is 441.14 g/mol.
Where can I buy starbld0003442?
You can request a quote for starbld0003442 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0003442?
Yes, KEHONG BIO provides custom synthesis services for starbld0003442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.