D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
TL;DR: D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid (CAS 72002-54-1) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Also Known As: lycoperodine I, D-Tpi-OH, 4-Aminobenzonitrile, H-D-Tpi-OH, (R)-2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLIC ACID
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 72002-54-1 |
|---|---|
| SMILES | C1[C@@H](NCC2=C1C3=CC=CC=C3N2)C(=O)O |
| InChIKey | FSNCEEGOMTYXKY-SNVBAGLBSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid (CAS 72002-54-1), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: (3R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid.
Chemical Property Profile of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
Property Insights of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
The XLogP value of -1.2 indicates that D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid. Following Lipinski's Rule of Five, D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid has 3 hydrogen bond donor(s) and 3 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 D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid?
The CAS number of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid is 72002-54-1.
What is the molecular formula of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid?
The molecular formula of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid is C12H12N2O2.
What is the molecular weight of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid?
The molecular weight of D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid is 216.09 g/mol.
Where can I buy D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid?
You can request a quote for D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.