(+)-Thermopsine
TL;DR: (+)-Thermopsine (CAS 53584-33-1) is a chemical compound with molecular formula C15H20N2O and molecular weight 244.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9S,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one
Also Known As: Hexalupine, (+)-Thermopsine, Hexalupin, Thermopsine, 11,12,13,14-Tetradehydrospartein-15-one
| Molecular Formula | C15H20N2O |
|---|---|
| Molecular Weight | 244.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.15756 |
| Heavy Atoms | 18 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 53584-33-1 |
|---|---|
| SMILES | C1CCN2C[C@@H]3C[C@H]([C@H]2C1)CN4C3=CC=CC4=O |
| InChIKey | FQEQMASDZFXSJI-RWMBFGLXSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+)-Thermopsine (CAS 53584-33-1), with molecular formula C15H20N2O and molecular weight 244.16 g/mol. IUPAC: (1S,9S,10R)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one.
Chemical Property Profile of (+)-Thermopsine
Property Insights of (+)-Thermopsine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-Thermopsine. With a topological polar surface area (TPSA) of 23.6 Ų, (+)-Thermopsine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-Thermopsine 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 (+)-Thermopsine?
The CAS number of (+)-Thermopsine is 53584-33-1.
What is the molecular formula of (+)-Thermopsine?
The molecular formula of (+)-Thermopsine is C15H20N2O.
What is the molecular weight of (+)-Thermopsine?
The molecular weight of (+)-Thermopsine is 244.16 g/mol.
Where can I buy (+)-Thermopsine?
You can request a quote for (+)-Thermopsine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Thermopsine?
Yes, KEHONG BIO provides custom synthesis services for (+)-Thermopsine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.