(S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid
TL;DR: (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid (CAS 113934-65-9) is a chemical compound with molecular formula C18H16N2O4 and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanoic acid
Also Known As: (2S)-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanoic acid, (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid, 2-(1-methyl-2,4-dioxo-quinazolin-3-yl)-3-phenyl-propanoic Acid, (2S)-2-(1-methyl-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-phenylpropanoic acid
| Molecular Formula | C18H16N2O4 |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 1.5686 |
| Topological Polar Surface Area | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.111 |
| Heavy Atoms | 24 |
| Complexity | 1018.60846 |
Chemical Identifiers
| CAS Number | 113934-65-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=O)N(C1=O)[C@@H](CC3=CC=CC=C3)C(=O)O |
Product Overview
(S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid (CAS 113934-65-9), with molecular formula C18H16N2O4 and molecular weight 324.11 g/mol. IUPAC: (2S)-2-(1-methyl-2,4-dioxoquinazolin-3-yl)-3-phenylpropanoic acid.
Chemical Property Profile of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid
Property Insights of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid
The XLogP value of 1.5686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid has 1 hydrogen bond donor(s) and 3 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)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid?
The CAS number of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid is 113934-65-9.
What is the molecular formula of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid is C18H16N2O4.
What is the molecular weight of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid is 324.11 g/mol.
Where can I buy (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(1-methyl-2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.