![methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate structure](/static/products/4894/489443-78-9.webp)
methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
TL;DR: methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate (CAS 489443-78-9) is a chemical compound with molecular formula C25H28N2O3S2 and molecular weight 468.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(adamantane-1-carbonyl)-3-amino-6-methyl-4-thiophen-2-yl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
Also Known As: methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate, methyl 2-(adamantane-1-carbonyl)-3-amino-6-methyl-4-thiophen-2-yl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate, methyl 3-amino-6-methyl-4-(thiophen-2-yl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate, methyl 2-((1s,3s)-adamantane-1-carbonyl)-3-amino-6-methyl-4-(thiophen-2-yl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate, methyl 2-(adamantanylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothiop heno[2,3-b]pyridine-5-carboxylate
| Molecular Formula | C25H28N2O3S2 |
|---|---|
| Molecular Weight | 468.15 g/mol |
| LogP | 5.7953 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.15414 |
| Heavy Atoms | 32 |
| Complexity | 1109.075 |
Chemical Identifiers
| CAS Number | 489443-78-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)SC(=C2N)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CS6)C(=O)OC |
Product Overview
methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate (CAS 489443-78-9), with molecular formula C25H28N2O3S2 and molecular weight 468.15 g/mol. IUPAC: methyl 2-(adamantane-1-carbonyl)-3-amino-6-methyl-4-thiophen-2-yl-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate.
Chemical Property Profile of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
Property Insights of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
The XLogP value of 5.7953 indicates that methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate. Following Lipinski's Rule of Five, methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate?
The CAS number of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate is 489443-78-9.
What is the molecular formula of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate?
The molecular formula of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate is C25H28N2O3S2.
What is the molecular weight of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate?
The molecular weight of methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate is 468.15 g/mol.
Where can I buy methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate?
You can request a quote for methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(1-adamantylcarbonyl)-3-amino-6-methyl-4-(2-thienyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.