Platynecine 7,9-cinnamate diester
TL;DR: Platynecine 7,9-cinnamate diester (CAS 39818-16-1) is a chemical compound with molecular formula C26H27NO4 and molecular weight 417.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,7R,8R)-7-[(E)-3-phenylprop-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-3-phenylprop-2-enoate
Also Known As: Platynecine 7,9-cinnamate diester, [(1S,7R,8R)-7-[(E)-3-phenylprop-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-3-phenylprop-2-enoate, 2-Propenoic acid, 3-phenyl-, hexahydro-7-(((1-oxo-3-phenyl-2-propenyl)oxy)methyl)-1H-pyrrolizin-1-yl ester, (1R-(1alpha,7alpha,7abeta))-, [(1S,7R,7aR)-7-{[(2E)-3-Phenylprop-2-enoyl]oxy}hexahydro-1H-pyrrolizin-1-yl]methyl (2E)-3-phenylprop-2-enoate
| Molecular Formula | C26H27NO4 |
|---|---|
| Molecular Weight | 417.19 g/mol |
| LogP | 3.9624 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.194 |
| Heavy Atoms | 31 |
| Complexity | 938.39404 |
Chemical Identifiers
| CAS Number | 39818-16-1 |
|---|---|
| SMILES | C1CN2CC[C@H]([C@H]2[C@H]1COC(=O)/C=C/C3=CC=CC=C3)OC(=O)/C=C/C4=CC=CC=C4 |
Product Overview
Platynecine 7,9-cinnamate diester (CAS 39818-16-1), with molecular formula C26H27NO4 and molecular weight 417.19 g/mol. IUPAC: [(1S,7R,8R)-7-[(E)-3-phenylprop-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-3-phenylprop-2-enoate.
Chemical Property Profile of Platynecine 7,9-cinnamate diester
Property Insights of Platynecine 7,9-cinnamate diester
The XLogP value of 3.9624 indicates that Platynecine 7,9-cinnamate diester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, Platynecine 7,9-cinnamate diester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Platynecine 7,9-cinnamate diester has 0 hydrogen bond donor(s) and 5 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 Platynecine 7,9-cinnamate diester?
The CAS number of Platynecine 7,9-cinnamate diester is 39818-16-1.
What is the molecular formula of Platynecine 7,9-cinnamate diester?
The molecular formula of Platynecine 7,9-cinnamate diester is C26H27NO4.
What is the molecular weight of Platynecine 7,9-cinnamate diester?
The molecular weight of Platynecine 7,9-cinnamate diester is 417.19 g/mol.
Where can I buy Platynecine 7,9-cinnamate diester?
You can request a quote for Platynecine 7,9-cinnamate diester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Platynecine 7,9-cinnamate diester?
Yes, KEHONG BIO provides custom synthesis services for Platynecine 7,9-cinnamate diester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.