Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-
TL;DR: Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- (CAS 10187-79-8) is a chemical compound with molecular formula C9H9N5O4 and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methyl-5-(5-nitrofuran-2-yl)-1,2,4-triazol-3-yl]acetamide
Also Known As: s-Triazole, 5-acetamido-1-methyl-3-(5-nitro-2-furyl)-, ACETAMIDE, N-(1-METHYL-3-(5-NITRO-2-FURYL)-s-TRIAZOL-5-YL)-, N-[2-methyl-5-(5-nitrofuran-2-yl)-1,2,4-triazol-3-yl]acetamide, Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-1H-1,2,4-triazol-5-yl)-, N-[1-Methyl-3-(5-nitro-2-furyl)-1H-1,2,4-triazol-5-yl]acetamide
| Molecular Formula | C9H9N5O4 |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.06546 |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 10187-79-8 |
|---|---|
| SMILES | CC(=O)NC1=NC(=NN1C)C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | VSMVDSLPLUCSKC-UHFFFAOYSA-N |
Product Overview
Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- (CAS 10187-79-8), with molecular formula C9H9N5O4 and molecular weight 251.07 g/mol. IUPAC: N-[2-methyl-5-(5-nitrofuran-2-yl)-1,2,4-triazol-3-yl]acetamide.
Chemical Property Profile of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-
Property Insights of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-. Following Lipinski's Rule of Five, Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- 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 Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-?
The CAS number of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- is 10187-79-8.
What is the molecular formula of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-?
The molecular formula of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- is C9H9N5O4.
What is the molecular weight of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-?
The molecular weight of Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- is 251.07 g/mol.
Where can I buy Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-?
You can request a quote for Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-(1-methyl-3-(5-nitro-2-furyl)-s-triazol-5-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.