Benzyltetrahydropalmatine
TL;DR: Benzyltetrahydropalmatine (CAS 1001054-52-9) is a chemical compound with molecular formula C28H31NO4 and molecular weight 445.2253 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-benzyl-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Also Known As: BTHP, Benzyltetrahydropalmatine, 2,8-Diazaspiro[4.5]decane, 2-cyclobutyl-8-(phenylmethyl)-, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-8-(phenylmethyl)-, 8-benzyl-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Technical Specifications
| Molecular Formula | C28H31NO4 |
| Molecular Weight | 445.2253 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.2253 Da |
| Heavy Atoms | 33 |
| Complexity | 625.0 |
| SMILES | COC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2CC5=CC=CC=C5)OC)OC)C=C1)OC |
| InChIKey | SXTAUSJLLADWLQ-UHFFFAOYSA-N |
Chemical Property Profile of Benzyltetrahydropalmatine
Property Insights of Benzyltetrahydropalmatine
The XLogP value of 5.2 indicates that Benzyltetrahydropalmatine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.2 Ų, Benzyltetrahydropalmatine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyltetrahydropalmatine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzyltetrahydropalmatine?
The CAS number of Benzyltetrahydropalmatine is 1001054-52-9.
What is the molecular formula of Benzyltetrahydropalmatine?
The molecular formula of Benzyltetrahydropalmatine is C28H31NO4.
What is the molecular weight of Benzyltetrahydropalmatine?
The molecular weight of Benzyltetrahydropalmatine is 445.2253 g/mol.
Where can I buy Benzyltetrahydropalmatine?
You can request a quote for Benzyltetrahydropalmatine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzyltetrahydropalmatine?
Yes, CoreyChem provides custom synthesis services for Benzyltetrahydropalmatine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.