AE-848/40773121
TL;DR: AE-848/40773121 (CAS 378774-32-4) is a chemical compound with molecular formula C19H20N2S and molecular weight 308.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-phenyl-8-thia-6-azatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraen-3-amine
Also Known As: AE-848/40773121, 3-methyl-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-b]pyridin-4-amine, 3-methyl-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-c]pyridin-4-amine, 3-methyl-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-b]pyridin-4-ylamine
| Molecular Formula | C19H20N2S |
|---|---|
| Molecular Weight | 308.13 g/mol |
| LogP | 5.12282 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.1347 |
| Heavy Atoms | 22 |
| Complexity | 833.7576 |
Chemical Identifiers
| CAS Number | 378774-32-4 |
|---|---|
| SMILES | CC1=C(C2=C(N=C1C3=CC=CC=C3)SC4=C2CCCCC4)N |
Product Overview
AE-848/40773121 (CAS 378774-32-4), with molecular formula C19H20N2S and molecular weight 308.13 g/mol. IUPAC: 4-methyl-5-phenyl-8-thia-6-azatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraen-3-amine.
Chemical Property Profile of AE-848/40773121
Property Insights of AE-848/40773121
The XLogP value of 5.12282 indicates that AE-848/40773121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.91 Ų, AE-848/40773121 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/40773121 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/40773121?
The CAS number of AE-848/40773121 is 378774-32-4.
What is the molecular formula of AE-848/40773121?
The molecular formula of AE-848/40773121 is C19H20N2S.
What is the molecular weight of AE-848/40773121?
The molecular weight of AE-848/40773121 is 308.13 g/mol.
Where can I buy AE-848/40773121?
You can request a quote for AE-848/40773121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/40773121?
Yes, KEHONG BIO provides custom synthesis services for AE-848/40773121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.