![(3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid structure](/static/products/957/957023-75-5.png)
(3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid
TL;DR: (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid (CAS 957023-75-5) is a chemical compound with molecular formula C23H24N2O5 and molecular weight 408.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Also Known As: (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid, (S)-2-(3-(1H-indol-3-yl)propanoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
| Molecular Formula | C23H24N2O5 |
|---|---|
| Molecular Weight | 408.17 g/mol |
| LogP | 3.1558 |
| Topological Polar Surface Area | 91.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.16852 |
| Heavy Atoms | 30 |
| Complexity | 1104.1666 |
Chemical Identifiers
| CAS Number | 957023-75-5 |
|---|---|
| SMILES | COC1=C(C=C2CN([C@@H](CC2=C1)C(=O)O)C(=O)CCC3=CNC4=CC=CC=C43)OC |
Product Overview
(3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid (CAS 957023-75-5), with molecular formula C23H24N2O5 and molecular weight 408.17 g/mol. IUPAC: (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid.
Chemical Property Profile of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid
Property Insights of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid
The XLogP value of 3.1558 indicates that (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid. Following Lipinski's Rule of Five, (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid has 2 hydrogen bond donor(s) and 4 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 (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid?
The CAS number of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid is 957023-75-5.
What is the molecular formula of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid?
The molecular formula of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid is C23H24N2O5.
What is the molecular weight of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid?
The molecular weight of (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid is 408.17 g/mol.
Where can I buy (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid?
You can request a quote for (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-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 (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for (3S)-2-[3-(1H-indol-3-yl)propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.