番木瓜碱
TL;DR: 番木瓜碱 (CAS 3463-92-1) is a chemical compound with molecular formula C28H50N2O4 and molecular weight 478.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
番木瓜碱
13,26-dimethyl-2,15-dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione
Also Known As: Carpaine, Pseudocarpaine, dimethyl[?]dione, 13,26-dimethyl-2,15-dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione, 12,25-Diaza-13,26-dimethyl-2,15-dioxatricyclo[22.2.2.2<11,14>]triacontane-3,16-dione
| Molecular Formula | C28H50N2O4 |
|---|---|
| Molecular Weight | 478.38 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 478.37704 |
| Heavy Atoms | 34 |
| Complexity | 561.0 |
| Melting Point | 119 - 120 °C |
Chemical Identifiers
| CAS Number | 3463-92-1 |
|---|---|
| SMILES | CC1C2CCC(N1)CCCCCCCC(=O)OC3CCC(CCCCCCCC(=O)O2)NC3C |
| InChIKey | AMSCMASJCYVAIF-UHFFFAOYSA-N |
Product Overview
番木瓜碱 (CAS 3463-92-1), with molecular formula C28H50N2O4 and molecular weight 478.38 g/mol. IUPAC: 13,26-dimethyl-2,15-dioxa-12,25-diazatricyclo[22.2.2.211,14]triacontane-3,16-dione.
Chemical Property Profile of 番木瓜碱
Property Insights of 番木瓜碱
The XLogP value of 6.3 indicates that 番木瓜碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 番木瓜碱. Following Lipinski's Rule of Five, 番木瓜碱 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 番木瓜碱?
The CAS number of 番木瓜碱 is 3463-92-1.
What is the molecular formula of 番木瓜碱?
The molecular formula of 番木瓜碱 is C28H50N2O4.
What is the molecular weight of 番木瓜碱?
The molecular weight of 番木瓜碱 is 478.38 g/mol.
Where can I buy 番木瓜碱?
You can request a quote for 番木瓜碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 番木瓜碱?
Yes, KEHONG BIO provides custom synthesis services for 番木瓜碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.