AP-906/41471507
TL;DR: AP-906/41471507 (CAS 446280-89-3) is a chemical compound with molecular formula C20H28N2O3S and molecular weight 376.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[bis(prop-2-enyl)amino]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AP-906/41471507, ethyl 2-{[(diallylamino)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[[2-[bis(prop-2-enyl)amino]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[(N,N-diallylglycyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[2-(diprop-2-enylamino)acetylamino]-6-methyl-4,5,6,7-tetrahydrobenzo[b ]thiophene-3-carboxylate
| Molecular Formula | C20H28N2O3S |
|---|---|
| Molecular Weight | 376.18 g/mol |
| LogP | 3.6621 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 376.18207 |
| Heavy Atoms | 26 |
| Complexity | 670.8413 |
Chemical Identifiers
| CAS Number | 446280-89-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CN(CC=C)CC=C |
Product Overview
AP-906/41471507 (CAS 446280-89-3), with molecular formula C20H28N2O3S and molecular weight 376.18 g/mol. IUPAC: ethyl 2-[[2-[bis(prop-2-enyl)amino]acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AP-906/41471507
Property Insights of AP-906/41471507
The XLogP value of 3.6621 indicates that AP-906/41471507 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AP-906/41471507 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-906/41471507 has 1 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 AP-906/41471507?
The CAS number of AP-906/41471507 is 446280-89-3.
What is the molecular formula of AP-906/41471507?
The molecular formula of AP-906/41471507 is C20H28N2O3S.
What is the molecular weight of AP-906/41471507?
The molecular weight of AP-906/41471507 is 376.18 g/mol.
Where can I buy AP-906/41471507?
You can request a quote for AP-906/41471507 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41471507?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41471507 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.