1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-
TL;DR: 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- (CAS 57256-25-4) is a chemical compound with molecular formula C18H19NO5 and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
Also Known As: 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-, 6-hydroxy-1-(4-hydroxy-benzyl)-7-methoxy-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid, 6-Hydroxy-1-(4-hydroxybenzyl)-7-methoxy-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid #, 6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid
| Molecular Formula | C18H19NO5 |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.1263 |
| Heavy Atoms | 24 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 57256-25-4 |
|---|---|
| SMILES | COC1=C(C=C2CCNC(C2=C1)(CC3=CC=C(C=C3)O)C(=O)O)O |
| InChIKey | VZDPKTWMYYCQKK-UHFFFAOYSA-N |
Product Overview
1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- (CAS 57256-25-4), with molecular formula C18H19NO5 and molecular weight 329.13 g/mol. IUPAC: 6-hydroxy-1-[(4-hydroxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-isoquinoline-1-carboxylic acid.
Chemical Property Profile of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-
Property Insights of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-
The XLogP value of -0.1 indicates that 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- has 4 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 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-?
The CAS number of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- is 57256-25-4.
What is the molecular formula of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-?
The molecular formula of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- is C18H19NO5.
What is the molecular weight of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-?
The molecular weight of 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- is 329.13 g/mol.
Where can I buy 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-?
You can request a quote for 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydroisoquinolin-6-ol-1-carboxylic acid, 1-[4-hydroxybenzy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.