(S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid
TL;DR: (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid (CAS 956204-63-0) is a chemical compound with molecular formula C17H19N3O5 and molecular weight 345.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoyl]pyrrolidine-2-carboxylic acid
Also Known As: (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid, 1-[4-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)butanoyl]-L-proline, 1-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoyl]pyrrolidine-2-carboxylic Acid, (2S)-1-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoyl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C17H19N3O5 |
|---|---|
| Molecular Weight | 345.13 g/mol |
| LogP | 0.5456 |
| Topological Polar Surface Area | 112.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.13248 |
| Heavy Atoms | 25 |
| Complexity | 929.7606 |
Chemical Identifiers
| CAS Number | 956204-63-0 |
|---|---|
| SMILES | C1C[C@H](N(C1)C(=O)CCCN2C(=O)C3=CC=CC=C3NC2=O)C(=O)O |
Product Overview
(S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid (CAS 956204-63-0), with molecular formula C17H19N3O5 and molecular weight 345.13 g/mol. IUPAC: (2S)-1-[4-(2,4-dioxo-1H-quinazolin-3-yl)butanoyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid
Property Insights of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid
The XLogP value of 0.5456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid. The TPSA of 112.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-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 (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid?
The CAS number of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid is 956204-63-0.
What is the molecular formula of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid?
The molecular formula of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid is C17H19N3O5.
What is the molecular weight of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid?
The molecular weight of (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid is 345.13 g/mol.
Where can I buy (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid?
You can request a quote for (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)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 (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-1-(4-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)butanoyl)pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.