(S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid
TL;DR: (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid (CAS 956049-40-4) is a chemical compound with molecular formula C15H17N3O4 and molecular weight 303.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoic acid
Also Known As: N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-valine, (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid, 3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoic Acid, (2S)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoic acid
| Molecular Formula | C15H17N3O4 |
|---|---|
| Molecular Weight | 303.12 g/mol |
| LogP | 0.6219 |
| Topological Polar Surface Area | 101.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.12192 |
| Heavy Atoms | 22 |
| Complexity | 766.71674 |
Chemical Identifiers
| CAS Number | 956049-40-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)CN1C=NC2=CC=CC=C2C1=O |
Product Overview
(S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid (CAS 956049-40-4), with molecular formula C15H17N3O4 and molecular weight 303.12 g/mol. IUPAC: (2S)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]butanoic acid.
Chemical Property Profile of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid
Property Insights of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid
The XLogP value of 0.6219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid. The TPSA of 101.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid. Following Lipinski's Rule of Five, (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic 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)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid?
The CAS number of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid is 956049-40-4.
What is the molecular formula of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid?
The molecular formula of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid is C15H17N3O4.
What is the molecular weight of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid?
The molecular weight of (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid is 303.12 g/mol.
Where can I buy (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid?
You can request a quote for (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.