SC 118
TL;DR: SC 118 (CAS 59894-87-0) is a chemical compound with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-oxo-1,3,4,6,7,12b-hexahydro-[1,3]benzodioxolo[6,5-a]quinolizin-3-yl)propanenitrile
Also Known As: SC 118, 1,3,4,6,7,11b-Hexahydro-2-oxo-2H-(1,3)benzodioxolo(5,6-a)quinolizine-3-propanenitrile, 2H-(1,3)Benzodioxolo(5,6-a)quinolizine-3-propanenitrile, 1,3,4,6,7,11b-hexahydro-2-oxo-, 3-(2-oxo-1,3,4,6,7,12b-hexahydro-[1,3]benzodioxolo[6,5-a]quinolizin-3-yl)propanenitrile, 3-(2-Oxo-1,3,4,6,7,12b-hexahydro-2H,10H-[1,3]dioxolo[4,5-g]pyrido[2,1-a]isoquinolin-3-yl)propanenitrile
| Molecular Formula | C17H18N2O3 |
|---|---|
| Molecular Weight | 298.13 g/mol |
| LogP | 2.20728 |
| Topological Polar Surface Area | 62.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.13174 |
| Heavy Atoms | 22 |
| Complexity | 664.6033 |
Chemical Identifiers
| CAS Number | 59894-87-0 |
|---|---|
| SMILES | C1CN2CC(C(=O)CC2C3=CC4=C(C=C31)OCO4)CCC#N |
Product Overview
SC 118 (CAS 59894-87-0), with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol. IUPAC: 3-(2-oxo-1,3,4,6,7,12b-hexahydro-[1,3]benzodioxolo[6,5-a]quinolizin-3-yl)propanenitrile.
Chemical Property Profile of SC 118
Property Insights of SC 118
The XLogP value of 2.20728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SC 118. The TPSA of 62.56 Ų falls within the moderate polarity range, balancing permeability and solubility for SC 118. Following Lipinski's Rule of Five, SC 118 has 0 hydrogen bond donor(s) and 5 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 SC 118?
The CAS number of SC 118 is 59894-87-0.
What is the molecular formula of SC 118?
The molecular formula of SC 118 is C17H18N2O3.
What is the molecular weight of SC 118?
The molecular weight of SC 118 is 298.13 g/mol.
Where can I buy SC 118?
You can request a quote for SC 118 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SC 118?
Yes, KEHONG BIO provides custom synthesis services for SC 118 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.