starbld0002031
TL;DR: starbld0002031 (CAS 744268-53-9) is a chemical compound with molecular formula C25H35N5OS and molecular weight 453.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-tert-butylphenyl)-4-cyclopentyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide
Also Known As: starbld0002031, 2-{[5-(4-tert-butylphenyl)-4-cyclopentyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-cyano-1,2-dimethylpropyl)acetamide, 2-((5-(4-(tert-Butyl)phenyl)-4-cyclopentyl-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide, 2-[[5-(4-tert-butylphenyl)-4-cyclopentyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide
| Molecular Formula | C25H35N5OS |
|---|---|
| Molecular Weight | 453.26 g/mol |
| LogP | 5.50428 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 453.25623 |
| Heavy Atoms | 32 |
| Complexity | 977.2417 |
Chemical Identifiers
| CAS Number | 744268-53-9 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1C2CCCC2)C3=CC=C(C=C3)C(C)(C)C |
Product Overview
starbld0002031 (CAS 744268-53-9), with molecular formula C25H35N5OS and molecular weight 453.26 g/mol. IUPAC: 2-[[5-(4-tert-butylphenyl)-4-cyclopentyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide.
Chemical Property Profile of starbld0002031
Property Insights of starbld0002031
The XLogP value of 5.50428 indicates that starbld0002031 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 starbld0002031. Following Lipinski's Rule of Five, starbld0002031 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of starbld0002031?
The CAS number of starbld0002031 is 744268-53-9.
What is the molecular formula of starbld0002031?
The molecular formula of starbld0002031 is C25H35N5OS.
What is the molecular weight of starbld0002031?
The molecular weight of starbld0002031 is 453.26 g/mol.
Where can I buy starbld0002031?
You can request a quote for starbld0002031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0002031?
Yes, KEHONG BIO provides custom synthesis services for starbld0002031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.