净椒木元碱
TL;DR: 净椒木元碱 (CAS 83029-38-3) is a chemical compound with molecular formula C18H25NO3 and molecular weight 303.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
净椒木元碱
(E)-7-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)hept-2-enamide
Also Known As: Pipercallosidine, J2.055.628E, (E)-7-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)hept-2-enamide, (2E)-N-Isobutyl-7-(1,3-benzodioxole-5-yl)-2-heptenamide, (2E)-7-(1,3-Benzodioxol-5-yl)-N-isobutyl-2-heptenamide #
| Molecular Formula | C18H25NO3 |
|---|---|
| Molecular Weight | 303.18 g/mol |
| LogP | 3.4565 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 303.18344 |
| Heavy Atoms | 22 |
| Complexity | 523.0636 |
Chemical Identifiers
| CAS Number | 83029-38-3 |
|---|---|
| SMILES | CC(C)CNC(=O)/C=C/CCCCC1=CC2=C(C=C1)OCO2 |
Product Overview
净椒木元碱 (CAS 83029-38-3), with molecular formula C18H25NO3 and molecular weight 303.18 g/mol. IUPAC: (E)-7-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)hept-2-enamide.
Chemical Property Profile of 净椒木元碱
Property Insights of 净椒木元碱
The XLogP value of 3.4565 indicates that 净椒木元碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 净椒木元碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 净椒木元碱 has 1 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 净椒木元碱?
The CAS number of 净椒木元碱 is 83029-38-3.
What is the molecular formula of 净椒木元碱?
The molecular formula of 净椒木元碱 is C18H25NO3.
What is the molecular weight of 净椒木元碱?
The molecular weight of 净椒木元碱 is 303.18 g/mol.
Where can I buy 净椒木元碱?
You can request a quote for 净椒木元碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 净椒木元碱?
Yes, KEHONG BIO provides custom synthesis services for 净椒木元碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.