A1306/0059416
TL;DR: A1306/0059416 (CAS 339322-23-5) is a chemical compound with molecular formula C24H21N3O7S and molecular weight 495.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[[2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] thiophene-2-carboxylate
Also Known As: A1306/0059416, [4-[(E)-[[2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] thiophene-2-carboxylate, (E)-4-((2-(2-(2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamido)acetyl)hydrazono)methyl)-2-methoxyphenyl thiophene-2-carboxylate, 4-(2-{[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]acetyl}carbohydrazonoyl)-2-methoxyphenyl 2-thiophenecarboxylate, 4-[((E)-2-{2-[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]acetyl}hydrazono)methyl]-2-methoxyphenyl 2-thiophenecarboxylate
| Molecular Formula | C24H21N3O7S |
|---|---|
| Molecular Weight | 495.11 g/mol |
| LogP | 2.6272 |
| Topological Polar Surface Area | 124.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 495.11002 |
| Heavy Atoms | 35 |
| Complexity | 1258.0085 |
Chemical Identifiers
| CAS Number | 339322-23-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=O)CNC(=O)C2=CC3=C(C=C2)OCCO3)OC(=O)C4=CC=CS4 |
Product Overview
A1306/0059416 (CAS 339322-23-5), with molecular formula C24H21N3O7S and molecular weight 495.11 g/mol. IUPAC: [4-[(E)-[[2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] thiophene-2-carboxylate.
Chemical Property Profile of A1306/0059416
Property Insights of A1306/0059416
The XLogP value of 2.6272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1306/0059416. The TPSA of 124.55 Ų falls within the moderate polarity range, balancing permeability and solubility for A1306/0059416. Following Lipinski's Rule of Five, A1306/0059416 has 2 hydrogen bond donor(s) and 9 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 A1306/0059416?
The CAS number of A1306/0059416 is 339322-23-5.
What is the molecular formula of A1306/0059416?
The molecular formula of A1306/0059416 is C24H21N3O7S.
What is the molecular weight of A1306/0059416?
The molecular weight of A1306/0059416 is 495.11 g/mol.
Where can I buy A1306/0059416?
You can request a quote for A1306/0059416 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1306/0059416?
Yes, KEHONG BIO provides custom synthesis services for A1306/0059416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.