starbld0002387
TL;DR: starbld0002387 (CAS 757215-99-9) is a chemical compound with molecular formula C22H21F3N6OS and molecular weight 474.14 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-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: starbld0002387, N-(1-cyano-1,2-dimethylpropyl)-2-{[5-(pyridin-3-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-Cyano-3-methylbutan-2-yl)-2-((5-(pyridin-3-yl)-4-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-cyano-3-methylbutan-2-yl)-2-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H21F3N6OS |
|---|---|
| Molecular Weight | 474.14 g/mol |
| LogP | 4.49468 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 474.14496 |
| Heavy Atoms | 33 |
| Complexity | 1172.8645 |
Chemical Identifiers
| CAS Number | 757215-99-9 |
|---|---|
| SMILES | CC(C)C(C)(C#N)NC(=O)CSC1=NN=C(N1C2=CC=CC(=C2)C(F)(F)F)C3=CN=CC=C3 |
Product Overview
starbld0002387 (CAS 757215-99-9), with molecular formula C22H21F3N6OS and molecular weight 474.14 g/mol. IUPAC: N-(2-cyano-3-methylbutan-2-yl)-2-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of starbld0002387
Property Insights of starbld0002387
The XLogP value of 4.49468 indicates that starbld0002387 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.49 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0002387. Following Lipinski's Rule of Five, starbld0002387 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 starbld0002387?
The CAS number of starbld0002387 is 757215-99-9.
What is the molecular formula of starbld0002387?
The molecular formula of starbld0002387 is C22H21F3N6OS.
What is the molecular weight of starbld0002387?
The molecular weight of starbld0002387 is 474.14 g/mol.
Where can I buy starbld0002387?
You can request a quote for starbld0002387 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0002387?
Yes, KEHONG BIO provides custom synthesis services for starbld0002387 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.