AM-879/40736017
TL;DR: AM-879/40736017 (CAS 429647-98-3) is a chemical compound with molecular formula C18H18BrN3O3S2 and molecular weight 467.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5-bromopyridine-3-carbonyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AM-879/40736017, ethyl 2-[({[(5-bromopyridin-3-yl)carbonyl]amino}carbothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[(5-bromopyridine-3-carbonyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(3-(5-bromonicotinoyl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C18H18BrN3O3S2 |
|---|---|
| Molecular Weight | 467.00 g/mol |
| LogP | 4.0879 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.9973 |
| Heavy Atoms | 27 |
| Complexity | 897.97217 |
Chemical Identifiers
| CAS Number | 429647-98-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC(=CN=C3)Br |
Product Overview
AM-879/40736017 (CAS 429647-98-3), with molecular formula C18H18BrN3O3S2 and molecular weight 467.00 g/mol. IUPAC: ethyl 2-[(5-bromopyridine-3-carbonyl)carbamothioylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AM-879/40736017
Property Insights of AM-879/40736017
The XLogP value of 4.0879 indicates that AM-879/40736017 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AM-879/40736017. Following Lipinski's Rule of Five, AM-879/40736017 has 2 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 AM-879/40736017?
The CAS number of AM-879/40736017 is 429647-98-3.
What is the molecular formula of AM-879/40736017?
The molecular formula of AM-879/40736017 is C18H18BrN3O3S2.
What is the molecular weight of AM-879/40736017?
The molecular weight of AM-879/40736017 is 467.00 g/mol.
Where can I buy AM-879/40736017?
You can request a quote for AM-879/40736017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AM-879/40736017?
Yes, KEHONG BIO provides custom synthesis services for AM-879/40736017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.