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N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide
TL;DR: N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide (CAS 875871-63-9) is a chemical compound with molecular formula C19H16F3N5OS and molecular weight 419.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclopropyl-2-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide, N-cyclopropyl-2-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C19H16F3N5OS |
|---|---|
| Molecular Weight | 419.10 g/mol |
| LogP | 3.7188 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.10275 |
| Heavy Atoms | 29 |
| Complexity | 1018.18414 |
Chemical Identifiers
| CAS Number | 875871-63-9 |
|---|---|
| SMILES | C1CC1NC(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)C4=CN=CC=C4 |
Product Overview
N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide (CAS 875871-63-9), with molecular formula C19H16F3N5OS and molecular weight 419.10 g/mol. IUPAC: N-cyclopropyl-2-[[5-pyridin-3-yl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide
Property Insights of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide
The XLogP value of 3.7188 indicates that N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide. Following Lipinski's Rule of Five, N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide 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 N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide?
The CAS number of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide is 875871-63-9.
What is the molecular formula of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide?
The molecular formula of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide is C19H16F3N5OS.
What is the molecular weight of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide?
The molecular weight of N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide is 419.10 g/mol.
Where can I buy N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide?
You can request a quote for N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclopropyl-2-{5-(3-pyridyl)-4-[3-(trifluoromethyl)phenyl](1,2,4-triazol-3-y lthio)}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.