starbld0005096
TL;DR: starbld0005096 (CAS 744265-28-9) is a chemical compound with molecular formula C21H23N5O2S and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-benzyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide
Also Known As: starbld0005096, 2-{[4-benzyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1-cyano-1,2-dimethylpropyl)acetamide, 2-((4-Benzyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide, 2-[[4-benzyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide
| Molecular Formula | C21H23N5O2S |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 3.73298 |
| Topological Polar Surface Area | 96.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 409.15726 |
| Heavy Atoms | 29 |
| Complexity | 992.0104 |
Chemical Identifiers
| CAS Number | 744265-28-9 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CO3 |
Product Overview
starbld0005096 (CAS 744265-28-9), with molecular formula C21H23N5O2S and molecular weight 409.16 g/mol. IUPAC: 2-[[4-benzyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-3-methylbutan-2-yl)acetamide.
Chemical Property Profile of starbld0005096
Property Insights of starbld0005096
The XLogP value of 3.73298 indicates that starbld0005096 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.74 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0005096. Following Lipinski's Rule of Five, starbld0005096 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 starbld0005096?
The CAS number of starbld0005096 is 744265-28-9.
What is the molecular formula of starbld0005096?
The molecular formula of starbld0005096 is C21H23N5O2S.
What is the molecular weight of starbld0005096?
The molecular weight of starbld0005096 is 409.16 g/mol.
Where can I buy starbld0005096?
You can request a quote for starbld0005096 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0005096?
Yes, KEHONG BIO provides custom synthesis services for starbld0005096 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.