舒奈吡琼
TL;DR: 舒奈吡琼 (CAS 148408-65-5) is a chemical compound with molecular formula C17H23N5O2 and molecular weight 329.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
舒奈吡琼
1-[[(7S,9aS)-2-pyrimidin-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-7-yl]methyl]pyrrolidine-2,5-dione
Also Known As: sunepitron, sunepitronum, Sunepitron [INN], Sunepitron Free Base, Sunepitron Hydrochloride
| Molecular Formula | C17H23N5O2 |
|---|---|
| Molecular Weight | 329.19 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.18518 |
| Heavy Atoms | 24 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 148408-65-5 |
|---|---|
| SMILES | C1C[C@H]2CN(CCN2C[C@H]1CN3C(=O)CCC3=O)C4=NC=CC=N4 |
| InChIKey | UXWBIYCPUVWKHP-KBPBESRZSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
舒奈吡琼 (CAS 148408-65-5), with molecular formula C17H23N5O2 and molecular weight 329.19 g/mol. IUPAC: 1-[[(7S,9aS)-2-pyrimidin-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-7-yl]methyl]pyrrolidine-2,5-dione.
Chemical Property Profile of 舒奈吡琼
Property Insights of 舒奈吡琼
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 舒奈吡琼. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 舒奈吡琼. Following Lipinski's Rule of Five, 舒奈吡琼 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 舒奈吡琼?
The CAS number of 舒奈吡琼 is 148408-65-5.
What is the molecular formula of 舒奈吡琼?
The molecular formula of 舒奈吡琼 is C17H23N5O2.
What is the molecular weight of 舒奈吡琼?
The molecular weight of 舒奈吡琼 is 329.19 g/mol.
Where can I buy 舒奈吡琼?
You can request a quote for 舒奈吡琼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 舒奈吡琼?
Yes, KEHONG BIO provides custom synthesis services for 舒奈吡琼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.