Platynecine 7,9-phenylacetate diester
TL;DR: Platynecine 7,9-phenylacetate diester (CAS 56576-95-5) is a chemical compound with molecular formula C24H27NO4 and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,7R,8R)-7-(2-phenylacetyl)oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl 2-phenylacetate
Also Known As: Platynecine 7,9-phenylacetate diester, Benzeneacetic acid, hexahydro-7-(((phenylacetyl)oxy)methyl)-1H-pyrrolizin-1-yl ester, (1R-(1alpha,7alpha,7abeta))-, {(1S,7R,7aR)-7-[(Phenylacetyl)oxy]hexahydro-1H-pyrrolizin-1-yl}methyl phenylacetate, [(1S,7R,8R)-7-(2-phenylacetyl)oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl 2-phenylacetate
| Molecular Formula | C24H27NO4 |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 393.194 |
| Heavy Atoms | 29 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 56576-95-5 |
|---|---|
| SMILES | C1CN2CC[C@H]([C@H]2[C@H]1COC(=O)CC3=CC=CC=C3)OC(=O)CC4=CC=CC=C4 |
| InChIKey | ASOLKEKLKBMHPH-PQNGQFLHSA-N |
Product Overview
Platynecine 7,9-phenylacetate diester (CAS 56576-95-5), with molecular formula C24H27NO4 and molecular weight 393.19 g/mol. IUPAC: [(1S,7R,8R)-7-(2-phenylacetyl)oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl 2-phenylacetate.
Chemical Property Profile of Platynecine 7,9-phenylacetate diester
Property Insights of Platynecine 7,9-phenylacetate diester
The XLogP value of 3.9 indicates that Platynecine 7,9-phenylacetate diester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Platynecine 7,9-phenylacetate diester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Platynecine 7,9-phenylacetate 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-phenylacetate diester?
The CAS number of Platynecine 7,9-phenylacetate diester is 56576-95-5.
What is the molecular formula of Platynecine 7,9-phenylacetate diester?
The molecular formula of Platynecine 7,9-phenylacetate diester is C24H27NO4.
What is the molecular weight of Platynecine 7,9-phenylacetate diester?
The molecular weight of Platynecine 7,9-phenylacetate diester is 393.19 g/mol.
Where can I buy Platynecine 7,9-phenylacetate diester?
You can request a quote for Platynecine 7,9-phenylacetate 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-phenylacetate diester?
Yes, KEHONG BIO provides custom synthesis services for Platynecine 7,9-phenylacetate diester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.