AE-848/34162005
TL;DR: AE-848/34162005 (CAS 155473-99-7) is a chemical compound with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-6-methylsulfanyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: AE-848/34162005, 3,3-dimethyl-6-(methylsulfanyl)-8-(4-morpholinyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-6-(methylthio)-8-morpholino-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 3,3-dimethyl-6-methylsulfanyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 3,3-Dimethyl-6-methylsulfanyl-8-morpholin-4-yl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C16H21N3O2S |
|---|---|
| Molecular Weight | 319.14 g/mol |
| LogP | 2.36308 |
| Topological Polar Surface Area | 58.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.13544 |
| Heavy Atoms | 22 |
| Complexity | 618.7974 |
Chemical Identifiers
| CAS Number | 155473-99-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC(=C2C#N)SC)N3CCOCC3)C |
Product Overview
AE-848/34162005 (CAS 155473-99-7), with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol. IUPAC: 3,3-dimethyl-6-methylsulfanyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of AE-848/34162005
Property Insights of AE-848/34162005
The XLogP value of 2.36308 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AE-848/34162005. With a topological polar surface area (TPSA) of 58.38 Ų, AE-848/34162005 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/34162005 has 0 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 AE-848/34162005?
The CAS number of AE-848/34162005 is 155473-99-7.
What is the molecular formula of AE-848/34162005?
The molecular formula of AE-848/34162005 is C16H21N3O2S.
What is the molecular weight of AE-848/34162005?
The molecular weight of AE-848/34162005 is 319.14 g/mol.
Where can I buy AE-848/34162005?
You can request a quote for AE-848/34162005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/34162005?
Yes, KEHONG BIO provides custom synthesis services for AE-848/34162005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.