AE-848/13196126
TL;DR: AE-848/13196126 (CAS 302344-57-6) is a chemical compound with molecular formula C15H22N4O and molecular weight 274.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-8-(2-methylpropyl)-11-oxa-4,5,7-triazatricyclo[7.4.0.02,6]trideca-1(9),2,5,7-tetraen-3-amine
Also Known As: AE-848/13196126, 5-isobutyl-8,8-dimethyl-3,6,8,9-tetrahydropyrano[4,3-d]pyrazolo[3,4-b]pyridin-1-amine, 5-Isobutyl-8,8-dimethyl-3,6,8,9-tetrahydro-7-oxa-2,3,4-triaza-cyclopenta[a]naphthalen-1-ylamine, 8,8-dimethyl-5-(2-methylpropyl)-3,6,8,9-tetrahydropyrano[4,3-d]pyrazolo[3,4-b]pyridin-1-amine
| Molecular Formula | C15H22N4O |
|---|---|
| Molecular Weight | 274.18 g/mol |
| LogP | 2.5899 |
| Topological Polar Surface Area | 76.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.17935 |
| Heavy Atoms | 20 |
| Complexity | 657.42755 |
Chemical Identifiers
| CAS Number | 302344-57-6 |
|---|---|
| SMILES | CC(C)CC1=NC2=NNC(=C2C3=C1COC(C3)(C)C)N |
Product Overview
AE-848/13196126 (CAS 302344-57-6), with molecular formula C15H22N4O and molecular weight 274.18 g/mol. IUPAC: 12,12-dimethyl-8-(2-methylpropyl)-11-oxa-4,5,7-triazatricyclo[7.4.0.02,6]trideca-1(9),2,5,7-tetraen-3-amine.
Chemical Property Profile of AE-848/13196126
Property Insights of AE-848/13196126
The XLogP value of 2.5899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AE-848/13196126. The TPSA of 76.82 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/13196126. Following Lipinski's Rule of Five, AE-848/13196126 has 2 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-848/13196126?
The CAS number of AE-848/13196126 is 302344-57-6.
What is the molecular formula of AE-848/13196126?
The molecular formula of AE-848/13196126 is C15H22N4O.
What is the molecular weight of AE-848/13196126?
The molecular weight of AE-848/13196126 is 274.18 g/mol.
Where can I buy AE-848/13196126?
You can request a quote for AE-848/13196126 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/13196126?
Yes, KEHONG BIO provides custom synthesis services for AE-848/13196126 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.