starbld0008518
TL;DR: starbld0008518 (CAS 756850-53-0) is a chemical compound with molecular formula C20H27FN6OS and molecular weight 418.20 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-[[5-[1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: starbld0008518, N-(1-cyano-1,2-dimethylpropyl)-2-({5-[1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(2-Cyano-3-methylbutan-2-yl)-2-((5-(1-(dimethylamino)ethyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-cyano-3-methylbutan-2-yl)-2-[[5-[1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C20H27FN6OS |
|---|---|
| Molecular Weight | 418.20 g/mol |
| LogP | 3.17558 |
| Topological Polar Surface Area | 86.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.1951 |
| Heavy Atoms | 29 |
| Complexity | 889.36664 |
Chemical Identifiers
| CAS Number | 756850-53-0 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)F)C(C)N(C)C |
Product Overview
starbld0008518 (CAS 756850-53-0), with molecular formula C20H27FN6OS and molecular weight 418.20 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-[[5-[1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of starbld0008518
Property Insights of starbld0008518
The XLogP value of 3.17558 indicates that starbld0008518 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.84 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0008518. Following Lipinski's Rule of Five, starbld0008518 has 1 hydrogen bond donor(s) and 6 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 starbld0008518?
The CAS number of starbld0008518 is 756850-53-0.
What is the molecular formula of starbld0008518?
The molecular formula of starbld0008518 is C20H27FN6OS.
What is the molecular weight of starbld0008518?
The molecular weight of starbld0008518 is 418.20 g/mol.
Where can I buy starbld0008518?
You can request a quote for starbld0008518 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0008518?
Yes, KEHONG BIO provides custom synthesis services for starbld0008518 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.