N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide
TL;DR: N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide (CAS 828291-01-6) is a chemical compound with molecular formula C15H13F2N5O2S and molecular weight 365.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide
Also Known As: N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide, N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide, N-[3-(DIFLUOROMETHYL)-5-(ETHYLSULFANYL)-4H-1,2,4-TRIAZOL-4-YL]-5-PHENYL-3-ISOXAZOLECARBOXAMIDE
| Molecular Formula | C15H13F2N5O2S |
|---|---|
| Molecular Weight | 365.08 g/mol |
| LogP | 3.3666 |
| Topological Polar Surface Area | 85.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.0758 |
| Heavy Atoms | 25 |
| Complexity | 865.9462 |
Chemical Identifiers
| CAS Number | 828291-01-6 |
|---|---|
| SMILES | CCSC1=NN=C(N1NC(=O)C2=NOC(=C2)C3=CC=CC=C3)C(F)F |
Product Overview
N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide (CAS 828291-01-6), with molecular formula C15H13F2N5O2S and molecular weight 365.08 g/mol. IUPAC: N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide.
Chemical Property Profile of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide
Property Insights of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide
The XLogP value of 3.3666 indicates that N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide. Following Lipinski's Rule of Five, N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide 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 N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide?
The CAS number of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide is 828291-01-6.
What is the molecular formula of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide?
The molecular formula of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide is C15H13F2N5O2S.
What is the molecular weight of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide?
The molecular weight of N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide is 365.08 g/mol.
Where can I buy N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide?
You can request a quote for N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-5-phenyl-1,2-oxazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.