RS 79948-197
TL;DR: RS 79948-197 (CAS 158854-42-3) is a chemical compound with molecular formula C19H29ClN2O3S and molecular weight 400.15875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8aR,12aS,13aS)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine;hydrochloride
Also Known As: RS 79948 hydrochloride, RS 79948-197, RS79948 hydrochloride, RS-79948-197, (8aR,12aS,13aS)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine;hydrochloride
Technical Specifications
| Molecular Formula | C19H29ClN2O3S |
| Molecular Weight | 400.15875 g/mol |
| XLogP | 2.8502 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.15875 Da |
| Heavy Atoms | 26 |
| Complexity | 576.0 |
| SMILES | CCS(=O)(=O)N1CCC[C@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C=C(C=C4)OC.Cl |
| InChIKey | DZTZUOBWDBPPJQ-BQBHMPFISA-N |
Chemical Property Profile of RS 79948-197
Property Insights of RS 79948-197
The XLogP value of 2.8502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RS 79948-197. With a topological polar surface area (TPSA) of 58.2 Ų, RS 79948-197 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RS 79948-197 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RS 79948-197?
The CAS number of RS 79948-197 is 158854-42-3.
What is the molecular formula of RS 79948-197?
The molecular formula of RS 79948-197 is C19H29ClN2O3S.
What is the molecular weight of RS 79948-197?
The molecular weight of RS 79948-197 is 400.15875 g/mol.
Where can I buy RS 79948-197?
You can request a quote for RS 79948-197 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RS 79948-197?
Yes, CoreyChem provides custom synthesis services for RS 79948-197 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.