(S)-cis-N-Methylstylopine
TL;DR: (S)-cis-N-Methylstylopine (CAS 113349-14-7) is a chemical compound with molecular formula C20H20NO4+ and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,13S)-13-methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaene
Also Known As: (S)-cis-N-methylstylopine, N-methylstylopine, (-)-N-Methylstylopine, J1.767.334C, (1S,13S)-13-methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaene
| Molecular Formula | C20H20NO4+ |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 2.9441 |
| Topological Polar Surface Area | 36.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 338.13922 |
| Heavy Atoms | 25 |
| Complexity | 909.05457 |
Chemical Identifiers
| CAS Number | 113349-14-7 |
|---|---|
| SMILES | C[N@@+]12CCC3=CC4=C(C=C3[C@@H]1CC5=C(C2)C6=C(C=C5)OCO6)OCO4 |
Product Overview
(S)-cis-N-Methylstylopine (CAS 113349-14-7), with molecular formula C20H20NO4+ and molecular weight 338.14 g/mol. IUPAC: (1S,13S)-13-methyl-5,7,17,19-tetraoxa-13-azoniahexacyclo[11.11.0.02,10.04,8.015,23.016,20]tetracosa-2,4(8),9,15(23),16(20),21-hexaene.
Chemical Property Profile of (S)-cis-N-Methylstylopine
Property Insights of (S)-cis-N-Methylstylopine
The XLogP value of 2.9441 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-cis-N-Methylstylopine. With a topological polar surface area (TPSA) of 36.92 Ų, (S)-cis-N-Methylstylopine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-cis-N-Methylstylopine has 0 hydrogen bond donor(s) and 4 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 (S)-cis-N-Methylstylopine?
The CAS number of (S)-cis-N-Methylstylopine is 113349-14-7.
What is the molecular formula of (S)-cis-N-Methylstylopine?
The molecular formula of (S)-cis-N-Methylstylopine is C20H20NO4+.
What is the molecular weight of (S)-cis-N-Methylstylopine?
The molecular weight of (S)-cis-N-Methylstylopine is 338.14 g/mol.
Where can I buy (S)-cis-N-Methylstylopine?
You can request a quote for (S)-cis-N-Methylstylopine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-cis-N-Methylstylopine?
Yes, KEHONG BIO provides custom synthesis services for (S)-cis-N-Methylstylopine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.