![(S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid structure](/static/products/117/1173681-86-1.webp)
(S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid
TL;DR: (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid (CAS 1173681-86-1) is a chemical compound with molecular formula C23H29N3O5 and molecular weight 427.21072 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[6-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]hexanoyl]piperidine-4-carboxylic acid
Also Known As: (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid, 1-[6-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]hexanoyl]piperidine-4-carboxylic acid, 1-{6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanoyl}piperidine-4-carboxylic acid
Technical Specifications
| Molecular Formula | C23H29N3O5 |
| Molecular Weight | 427.21072 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 98.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.21072 Da |
| Heavy Atoms | 31 |
| Complexity | 718.0 |
| SMILES | C1CN(CCC1C(=O)O)C(=O)CCCCCN2C(=O)[C@@H]3CC4=CC=CC=C4CN3C2=O |
| InChIKey | CAJNJRJLMPUXSD-IBGZPJMESA-N |
Chemical Property Profile of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid
Property Insights of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid. The TPSA of 98.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid?
The CAS number of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid is 1173681-86-1.
What is the molecular formula of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid?
The molecular formula of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid is C23H29N3O5.
What is the molecular weight of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid?
The molecular weight of (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid is 427.21072 g/mol.
Where can I buy (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid?
You can request a quote for (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for (S)-1-(6-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)hexanoyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.