R,R-Pampulhamine
TL;DR: R,R-Pampulhamine (CAS 110300-71-5) is a chemical compound with molecular formula C36H40N2O6 and molecular weight 596.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
Also Known As: Pampulhamine, R,R-Pampulhamine, N2 -Demethyldaurisoline, KST-1A0887, J2.403.085G
| Molecular Formula | C36H40N2O6 |
|---|---|
| Molecular Weight | 596.29 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 596.28864 |
| Heavy Atoms | 44 |
| Complexity | 887.0 |
Chemical Identifiers
| CAS Number | 110300-71-5 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC(=C(C=C3)O)OC4=CC=C(C=C4)C[C@@H]5C6=CC(=C(C=C6CCN5)OC)OC)O)OC |
| InChIKey | AIFMEJGBSFZMJP-LOYHVIPDSA-N |
Product Overview
R,R-Pampulhamine (CAS 110300-71-5), with molecular formula C36H40N2O6 and molecular weight 596.29 g/mol. IUPAC: (1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol.
Chemical Property Profile of R,R-Pampulhamine
Property Insights of R,R-Pampulhamine
The XLogP value of 5.9 indicates that R,R-Pampulhamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for R,R-Pampulhamine. Following Lipinski's Rule of Five, R,R-Pampulhamine has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of R,R-Pampulhamine?
The CAS number of R,R-Pampulhamine is 110300-71-5.
What is the molecular formula of R,R-Pampulhamine?
The molecular formula of R,R-Pampulhamine is C36H40N2O6.
What is the molecular weight of R,R-Pampulhamine?
The molecular weight of R,R-Pampulhamine is 596.29 g/mol.
Where can I buy R,R-Pampulhamine?
You can request a quote for R,R-Pampulhamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for R,R-Pampulhamine?
Yes, KEHONG BIO provides custom synthesis services for R,R-Pampulhamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.