Dihydroisocodeine acid tartrate
TL;DR: Dihydroisocodeine acid tartrate (CAS 6414-38-6) is a chemical compound with molecular formula C22H29NO9 and molecular weight 451.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,7R,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;(2R,3R)-2,3-dihydroxybutanedioic acid
Also Known As: Dihydroisocodeine tartrate, DIHYDROCODEINE, Dihydroisocodeine acid tartrate, Isocodeine, dihydro-, tartrate (1:1), DIHYDROISOCODEINE ACID TARTRATE [MI]
| Molecular Formula | C22H29NO9 |
|---|---|
| Molecular Weight | 451.18 g/mol |
| LogP | -0.3975 |
| Topological Polar Surface Area | 156.99 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.18423 |
| Heavy Atoms | 32 |
| Complexity | 902.9077 |
Chemical Identifiers
| CAS Number | 6414-38-6 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@@H](CC4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
Product Overview
Dihydroisocodeine acid tartrate (CAS 6414-38-6), with molecular formula C22H29NO9 and molecular weight 451.18 g/mol. IUPAC: (4R,4aR,7R,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;(2R,3R)-2,3-dihydroxybutanedioic acid.
Chemical Property Profile of Dihydroisocodeine acid tartrate
Property Insights of Dihydroisocodeine acid tartrate
The XLogP value of -0.3975 indicates that Dihydroisocodeine acid tartrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.99 Ų indicates high polarity, suggesting Dihydroisocodeine acid tartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dihydroisocodeine acid tartrate has 5 hydrogen bond donor(s) and 8 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 Dihydroisocodeine acid tartrate?
The CAS number of Dihydroisocodeine acid tartrate is 6414-38-6.
What is the molecular formula of Dihydroisocodeine acid tartrate?
The molecular formula of Dihydroisocodeine acid tartrate is C22H29NO9.
What is the molecular weight of Dihydroisocodeine acid tartrate?
The molecular weight of Dihydroisocodeine acid tartrate is 451.18 g/mol.
Where can I buy Dihydroisocodeine acid tartrate?
You can request a quote for Dihydroisocodeine acid tartrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroisocodeine acid tartrate?
Yes, KEHONG BIO provides custom synthesis services for Dihydroisocodeine acid tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.