![2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide structure](/static/products/5698/5698-51-1.webp)
2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide
TL;DR: 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide (CAS 5698-51-1) is a chemical compound with molecular formula C14H15F2N5O2S and molecular weight 355.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide
Also Known As: 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide, 2-({4-Amino-5-[4-(difluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
| Molecular Formula | C14H15F2N5O2S |
|---|---|
| Molecular Weight | 355.09 g/mol |
| LogP | 1.6546 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.09146 |
| Heavy Atoms | 24 |
| Complexity | 705.6904 |
Chemical Identifiers
| CAS Number | 5698-51-1 |
|---|---|
| SMILES | C=CCNC(=O)CSC1=NN=C(N1N)C2=CC=C(C=C2)OC(F)F |
Product Overview
2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide (CAS 5698-51-1), with molecular formula C14H15F2N5O2S and molecular weight 355.09 g/mol. IUPAC: 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide.
Chemical Property Profile of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide
Property Insights of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide
The XLogP value of 1.6546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide. Following Lipinski's Rule of Five, 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide has 2 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 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide?
The CAS number of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide is 5698-51-1.
What is the molecular formula of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide?
The molecular formula of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide is C14H15F2N5O2S.
What is the molecular weight of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide?
The molecular weight of 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide is 355.09 g/mol.
Where can I buy 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide?
You can request a quote for 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.