![Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate structure](/static/products/862/862117-06-4.png)
Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate
TL;DR: Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate (CAS 862117-06-4) is a chemical compound with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate
Also Known As: Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate, methyl 3-(2-(3,4-dihydroisoquinolin-2(1H)-yl)acetamido)-4-methyl-1H-indole-2-carboxylate, methyl 3-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-4-methyl-1H-indole-2-carboxylate
| Molecular Formula | C22H23N3O3 |
|---|---|
| Molecular Weight | 377.17 g/mol |
| LogP | 3.25972 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.17395 |
| Heavy Atoms | 28 |
| Complexity | 1054.3617 |
Chemical Identifiers
| CAS Number | 862117-06-4 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)NC(=C2NC(=O)CN3CCC4=CC=CC=C4C3)C(=O)OC |
Product Overview
Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate (CAS 862117-06-4), with molecular formula C22H23N3O3 and molecular weight 377.17 g/mol. IUPAC: methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate.
Chemical Property Profile of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate
Property Insights of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate
The XLogP value of 3.25972 indicates that Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate 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 Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate?
The CAS number of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate is 862117-06-4.
What is the molecular formula of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate?
The molecular formula of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate is C22H23N3O3.
What is the molecular weight of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate?
The molecular weight of Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate is 377.17 g/mol.
Where can I buy Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate?
You can request a quote for Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-4-methyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.