AE-848/12560135
TL;DR: AE-848/12560135 (CAS 307341-25-9) is a chemical compound with molecular formula C17H14F2N2OS2 and molecular weight 364.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(difluoromethylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AE-848/12560135, 2-[(difluoromethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-(difluoromethylthio)-3-phenyl-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]py rimidin-4-one
| Molecular Formula | C17H14F2N2OS2 |
|---|---|
| Molecular Weight | 364.05 g/mol |
| LogP | 4.6407 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.05157 |
| Heavy Atoms | 24 |
| Complexity | 950.6192 |
Chemical Identifiers
| CAS Number | 307341-25-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SC(F)F |
Product Overview
AE-848/12560135 (CAS 307341-25-9), with molecular formula C17H14F2N2OS2 and molecular weight 364.05 g/mol. IUPAC: 2-(difluoromethylsulfanyl)-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AE-848/12560135
Property Insights of AE-848/12560135
The XLogP value of 4.6407 indicates that AE-848/12560135 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, AE-848/12560135 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/12560135 has 0 hydrogen bond donor(s) and 4 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 AE-848/12560135?
The CAS number of AE-848/12560135 is 307341-25-9.
What is the molecular formula of AE-848/12560135?
The molecular formula of AE-848/12560135 is C17H14F2N2OS2.
What is the molecular weight of AE-848/12560135?
The molecular weight of AE-848/12560135 is 364.05 g/mol.
Where can I buy AE-848/12560135?
You can request a quote for AE-848/12560135 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/12560135?
Yes, KEHONG BIO provides custom synthesis services for AE-848/12560135 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.