starbld0023656
TL;DR: starbld0023656 (CAS 686281-41-4) is a chemical compound with molecular formula C14H14F3N5OS and molecular weight 357.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
Also Known As: starbld0023656, 2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one, F3111-2111, 2-((4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl)thio)-1-(3,4-dihydroquinolin-1(2H)-yl)ethanone, 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone
| Molecular Formula | C14H14F3N5OS |
|---|---|
| Molecular Weight | 357.09 g/mol |
| LogP | 2.0822 |
| Topological Polar Surface Area | 77.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.08713 |
| Heavy Atoms | 24 |
| Complexity | 761.10846 |
Chemical Identifiers
| CAS Number | 686281-41-4 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NN=C(N3N)C(F)(F)F |
Product Overview
starbld0023656 (CAS 686281-41-4), with molecular formula C14H14F3N5OS and molecular weight 357.09 g/mol. IUPAC: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydro-2H-quinolin-1-yl)ethanone.
Chemical Property Profile of starbld0023656
Property Insights of starbld0023656
The XLogP value of 2.0822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for starbld0023656. The TPSA of 77.04 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0023656. Following Lipinski's Rule of Five, starbld0023656 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 starbld0023656?
The CAS number of starbld0023656 is 686281-41-4.
What is the molecular formula of starbld0023656?
The molecular formula of starbld0023656 is C14H14F3N5OS.
What is the molecular weight of starbld0023656?
The molecular weight of starbld0023656 is 357.09 g/mol.
Where can I buy starbld0023656?
You can request a quote for starbld0023656 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0023656?
Yes, KEHONG BIO provides custom synthesis services for starbld0023656 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.