Aphylline
TL;DR: Aphylline (CAS 577-37-7) is a chemical compound with molecular formula C15H24N2O and molecular weight 248.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,9R,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one
Also Known As: Aphylline, Oxosparteine, (+)-Aphylline, 7alpha-Spartein-10-one, (1R,2R,9R,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one
| Molecular Formula | C15H24N2O |
|---|---|
| Molecular Weight | 248.19 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.18886 |
| Heavy Atoms | 18 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 577-37-7 |
|---|---|
| SMILES | C1CCN2C[C@H]3C[C@H]([C@@H]2C1)C(=O)N4[C@@H]3CCCC4 |
| InChIKey | YQMWQSMYVPLYDI-SYQHCUMBSA-N |
Product Overview
Aphylline (CAS 577-37-7), with molecular formula C15H24N2O and molecular weight 248.19 g/mol. IUPAC: (1R,2R,9R,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one.
Chemical Property Profile of Aphylline
Property Insights of Aphylline
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aphylline. With a topological polar surface area (TPSA) of 23.6 Ų, Aphylline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aphylline has 0 hydrogen bond donor(s) and 2 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 Aphylline?
The CAS number of Aphylline is 577-37-7.
What is the molecular formula of Aphylline?
The molecular formula of Aphylline is C15H24N2O.
What is the molecular weight of Aphylline?
The molecular weight of Aphylline is 248.19 g/mol.
Where can I buy Aphylline?
You can request a quote for Aphylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aphylline?
Yes, KEHONG BIO provides custom synthesis services for Aphylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.