(2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid
TL;DR: (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid (CAS 956435-13-5) is a chemical compound with molecular formula C19H21N3O5 and molecular weight 371.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid
Also Known As: (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid, (2R)-1-[3-[(10aS)-1,3-bis(oxidanylidene)-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid, (2R)-1-[3-[(10aS)-1,3-diketo-10,10a-dihydro-5H-imidaz[1,5-b]isoquinolin-2-yl]propanoyl]proline, (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-1-oxopropyl]-2-pyrrolidinecarboxylic acid, (R)-1-(3-((S)-1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)propanoyl)pyrrolidine-2-carboxylic acid
| Molecular Formula | C19H21N3O5 |
|---|---|
| Molecular Weight | 371.15 g/mol |
| LogP | 0.8412 |
| Topological Polar Surface Area | 98.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.14813 |
| Heavy Atoms | 27 |
| Complexity | 780.31805 |
Chemical Identifiers
| CAS Number | 956435-13-5 |
|---|---|
| SMILES | C1C[C@@H](N(C1)C(=O)CCN2C(=O)[C@@H]3CC4=CC=CC=C4CN3C2=O)C(=O)O |
Product Overview
(2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid (CAS 956435-13-5), with molecular formula C19H21N3O5 and molecular weight 371.15 g/mol. IUPAC: (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid
Property Insights of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid
The XLogP value of 0.8412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid. The TPSA of 98.23 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid has 1 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 (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid?
The CAS number of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid is 956435-13-5.
What is the molecular formula of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid?
The molecular formula of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid is C19H21N3O5.
What is the molecular weight of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid?
The molecular weight of (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid is 371.15 g/mol.
Where can I buy (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid?
You can request a quote for (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (2R)-1-[3-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]propanoyl]pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.