Rugulovasine A
TL;DR: Rugulovasine A (CAS 26909-33-1) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R)-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-furan]-2'-one
Also Known As: Rugulovasine A, Rugulovasine B, RUGULOVASINE A [MI], (5R)-3'-methyl-(methylamino)spiro[[?]-5,5'-furan]-2'-one, cis-(+)-dihydro-4'-methyl-4-(methylamino)spiro[benz[cd]indole-5(1h),2'(5'h)-furan]-5'-one
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 26909-33-1 |
|---|---|
| SMILES | CC1=C[C@@]2([C@H](CC3=CNC4=CC=CC2=C34)NC)OC1=O |
| InChIKey | QTWQJTORJVFWAQ-XJKSGUPXSA-N |
Product Overview
Rugulovasine A (CAS 26909-33-1), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: (4S,5R)-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-furan]-2'-one.
Chemical Property Profile of Rugulovasine A
Property Insights of Rugulovasine A
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rugulovasine A. With a topological polar surface area (TPSA) of 54.1 Ų, Rugulovasine A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rugulovasine A has 2 hydrogen bond donor(s) and 3 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 Rugulovasine A?
The CAS number of Rugulovasine A is 26909-33-1.
What is the molecular formula of Rugulovasine A?
The molecular formula of Rugulovasine A is C16H16N2O2.
What is the molecular weight of Rugulovasine A?
The molecular weight of Rugulovasine A is 268.12 g/mol.
Where can I buy Rugulovasine A?
You can request a quote for Rugulovasine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rugulovasine A?
Yes, KEHONG BIO provides custom synthesis services for Rugulovasine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.