N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide
TL;DR: N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide (CAS 304451-07-8) is a chemical compound with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide
Also Known As: N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide, (E)-2-((1H-benzo[d]imidazol-2-yl)thio)-N'-((E)-3-(furan-2-yl)-2-methylallylidene)acetohydrazide, 2-(1H-1,3-BENZODIAZOL-2-YLSULFANYL)-N'-[(1E,2E)-3-(FURAN-2-YL)-2-METHYLPROP-2-EN-1-YLIDENE]ACETOHYDRAZIDE, 2-(1H-benzimidazol-2-ylsulfanyl)-N'-[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]acetohydrazide, 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide
| Molecular Formula | C17H16N4O2S |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 3.4535 |
| Topological Polar Surface Area | 83.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.0994 |
| Heavy Atoms | 24 |
| Complexity | 848.03253 |
Chemical Identifiers
| CAS Number | 304451-07-8 |
|---|---|
| SMILES | C/C(=C\C1=CC=CO1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2 |
Product Overview
N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide (CAS 304451-07-8), with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide.
Chemical Property Profile of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide
Property Insights of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide
The XLogP value of 3.4535 indicates that N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.28 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide. Following Lipinski's Rule of Five, N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide has 2 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-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide?
The CAS number of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide is 304451-07-8.
What is the molecular formula of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide?
The molecular formula of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide is C17H16N4O2S.
What is the molecular weight of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide?
The molecular weight of N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide is 340.10 g/mol.
Where can I buy N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide?
You can request a quote for N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide?
Yes, KEHONG BIO provides custom synthesis services for N-((1E,3E)-4-(2-furyl)-3-methyl-1-azabuta-1,3-dienyl)-2-benzimidazol-2-ylthioa cetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.