![(S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid structure](/static/products/117/1173685-01-2.png)
(S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid
TL;DR: (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid (CAS 1173685-01-2) is a chemical compound with molecular formula C15H18N4O4 and molecular weight 318.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-methyl-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]pentanoic acid
Also Known As: N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-leucine, (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid, (2S)-4-methyl-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]pentanoic acid, 4-METHYL-2-[2-(4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZIN-3-YL)ACETAMIDO]PENTANOIC ACID
| Molecular Formula | C15H18N4O4 |
|---|---|
| Molecular Weight | 318.13 g/mol |
| LogP | 0.407 |
| Topological Polar Surface Area | 114.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.1328 |
| Heavy Atoms | 23 |
| Complexity | 784.3857 |
Chemical Identifiers
| CAS Number | 1173685-01-2 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)CN1C(=O)C2=CC=CC=C2N=N1 |
Product Overview
(S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid (CAS 1173685-01-2), with molecular formula C15H18N4O4 and molecular weight 318.13 g/mol. IUPAC: (2S)-4-methyl-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]pentanoic acid.
Chemical Property Profile of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid
Property Insights of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid
The XLogP value of 0.407 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid. The TPSA of 114.18 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid. Following Lipinski's Rule of Five, (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid has 2 hydrogen bond donor(s) and 5 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)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid?
The CAS number of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid is 1173685-01-2.
What is the molecular formula of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid?
The molecular formula of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid is C15H18N4O4.
What is the molecular weight of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid?
The molecular weight of (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid is 318.13 g/mol.
Where can I buy (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid?
You can request a quote for (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-methyl-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.