Rugulovasine B
TL;DR: Rugulovasine B (CAS 26909-34-2) 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.
(4R,5R)-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-furan]-2'-one
Also Known As: Rugulovasine B, RUGULOVASINE B [MI], Spiro(benz(cd)indole-5(1H),2'(5'H)-furan)-5'-one, 3,4-dihydro-4'-methyl-4-(methylamino)-, (2'R,4R)-rel-, spiro(benz(cd)indole-5(1h),2'(5'h)-furan)-5'-one, 3,4-dihydro-4'-methyl-4-(methylamino)-,(2'r,4r)-rel-, (4R,5R)-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-uran]-2'-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 | 26909-34-2 |
|---|---|
| SMILES | CC1=C[C@@]2([C@@H](CC3=CNC4=CC=CC2=C34)NC)OC1=O |
| InChIKey | QTWQJTORJVFWAQ-CZUORRHYSA-N |
Product Overview
Rugulovasine B (CAS 26909-34-2), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: (4R,5R)-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-furan]-2'-one.
Chemical Property Profile of Rugulovasine B
Property Insights of Rugulovasine B
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rugulovasine B. With a topological polar surface area (TPSA) of 54.1 Ų, Rugulovasine B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rugulovasine B 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 B?
The CAS number of Rugulovasine B is 26909-34-2.
What is the molecular formula of Rugulovasine B?
The molecular formula of Rugulovasine B is C16H16N2O2.
What is the molecular weight of Rugulovasine B?
The molecular weight of Rugulovasine B is 268.12 g/mol.
Where can I buy Rugulovasine B?
You can request a quote for Rugulovasine B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rugulovasine B?
Yes, KEHONG BIO provides custom synthesis services for Rugulovasine B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.