![(S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid structure](/static/products/117/1173679-78-1.webp)
(S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid
TL;DR: (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid (CAS 1173679-78-1) is a chemical compound with molecular formula C12H12N4O4 and molecular weight 276.08585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]propanoic acid
Also Known As: (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid, N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-alanine, (2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]propanoic acid, 2-[2-(4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZIN-3-YL)ACETAMIDO]PROPANOIC ACID, 2-[[2-(10-oxo-7,8,9-triazabicyclo[4.4.0]deca-1,3,5,7-tetraen-9-yl)acetyl]amino]propanoic Acid
Technical Specifications
| Molecular Formula | C12H12N4O4 |
| Molecular Weight | 276.08585 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.08585 Da |
| Heavy Atoms | 20 |
| Complexity | 451.0 |
| SMILES | C[C@@H](C(=O)O)NC(=O)CN1C(=O)C2=CC=CC=C2N=N1 |
| InChIKey | DXLKBCNMVIPOJW-ZETCQYMHSA-N |
Chemical Property Profile of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid
Property Insights of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid. Following Lipinski's Rule of Five, (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid has 2 hydrogen bond donor(s) and 6 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)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid?
The CAS number of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid is 1173679-78-1.
What is the molecular formula of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid?
The molecular formula of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid is C12H12N4O4.
What is the molecular weight of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid?
The molecular weight of (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid is 276.08585 g/mol.
Where can I buy (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid?
You can request a quote for (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid?
Yes, CoreyChem provides custom synthesis services for (S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.