Phalaenopsine T
TL;DR: Phalaenopsine T (CAS 23412-97-7) is a chemical compound with molecular formula C20H27NO5 and molecular weight 361.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl) 4-O-methyl 2-benzyl-2-hydroxybutanedioate
Also Known As: Phalaenopsine T, Phalaenopsine Is, Phalaenopsine La, (2R)-2-Hydroxy-2-benzylbutanedioic acid 1-[[(4S,5S)-1-azabicyclo[3.3.0]octan-4-yl]methyl]4-methyl ester, (2S)-2-Hydroxy-2-benzylbutanedioic acid 1-[[(4S,5R)-1-azabicyclo[3.3.0]octan-4-yl]methyl]4-methyl ester
| Molecular Formula | C20H27NO5 |
|---|---|
| Molecular Weight | 361.19 g/mol |
| LogP | 1.5508 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 361.18893 |
| Heavy Atoms | 26 |
| Complexity | 634.3485 |
Chemical Identifiers
| CAS Number | 23412-97-7 |
|---|---|
| SMILES | COC(=O)CC(CC1=CC=CC=C1)(C(=O)OCC2CCN3C2CCC3)O |
Product Overview
Phalaenopsine T (CAS 23412-97-7), with molecular formula C20H27NO5 and molecular weight 361.19 g/mol. IUPAC: 1-O-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl) 4-O-methyl 2-benzyl-2-hydroxybutanedioate.
Chemical Property Profile of Phalaenopsine T
Property Insights of Phalaenopsine T
The XLogP value of 1.5508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phalaenopsine T. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Phalaenopsine T. Following Lipinski's Rule of Five, Phalaenopsine T has 1 hydrogen bond donor(s) and 6 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 Phalaenopsine T?
The CAS number of Phalaenopsine T is 23412-97-7.
What is the molecular formula of Phalaenopsine T?
The molecular formula of Phalaenopsine T is C20H27NO5.
What is the molecular weight of Phalaenopsine T?
The molecular weight of Phalaenopsine T is 361.19 g/mol.
Where can I buy Phalaenopsine T?
You can request a quote for Phalaenopsine T directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phalaenopsine T?
Yes, KEHONG BIO provides custom synthesis services for Phalaenopsine T and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.