N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine
TL;DR: N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine (CAS 35554-71-3) is a chemical compound with molecular formula C9H8N4O and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,E)-3-(furan-2-yl)-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine
Also Known As: (E)-N-((E)-3-(furan-2-yl)allylidene)-4H-1,2,4-triazol-4-amine, 3-(Furan-2-yl)-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine, N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine
| Molecular Formula | C9H8N4O |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 1.4184 |
| Topological Polar Surface Area | 56.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.06981 |
| Heavy Atoms | 14 |
| Complexity | 371.37125 |
Chemical Identifiers
| CAS Number | 35554-71-3 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C=N/N2C=NN=C2 |
Product Overview
N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine (CAS 35554-71-3), with molecular formula C9H8N4O and molecular weight 188.07 g/mol. IUPAC: (E,E)-3-(furan-2-yl)-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine.
Chemical Property Profile of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine
Property Insights of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine
The XLogP value of 1.4184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 56.21 Ų, N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine has 0 hydrogen bond donor(s) and 4 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-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine?
The CAS number of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine is 35554-71-3.
What is the molecular formula of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine?
The molecular formula of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine is C9H8N4O.
What is the molecular weight of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine?
The molecular weight of N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine is 188.07 g/mol.
Where can I buy N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine?
You can request a quote for N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.