2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-
TL;DR: 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- (CAS 120701-87-3) is a chemical compound with molecular formula C7H12N4O4S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2-amino-3-methyl-3-sulfino-4-(triazol-1-yl)butanoic acid
Also Known As: Tazobactam related compound A, Tazobactam Impurity A, Tazobactam USP RC A, Tazobactam metabolite M1, (2S,3S)-2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butanoic acid
| Molecular Formula | C7H12N4O4S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | -1.3296 |
| Topological Polar Surface Area | 131.33 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.05792 |
| Heavy Atoms | 16 |
| Complexity | 395.1009 |
Chemical Identifiers
| CAS Number | 120701-87-3 |
|---|---|
| SMILES | C[C@](CN1C=CN=N1)([C@H](C(=O)O)N)S(=O)O |
Product Overview
2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- (CAS 120701-87-3), with molecular formula C7H12N4O4S and molecular weight 248.06 g/mol. IUPAC: (2S,3S)-2-amino-3-methyl-3-sulfino-4-(triazol-1-yl)butanoic acid.
Chemical Property Profile of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-
Property Insights of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-
The XLogP value of -1.3296 indicates that 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-. Following Lipinski's Rule of Five, 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- has 3 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 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-?
The CAS number of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- is 120701-87-3.
What is the molecular formula of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-?
The molecular formula of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- is C7H12N4O4S.
What is the molecular weight of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-?
The molecular weight of 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- is 248.06 g/mol.
Where can I buy 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-?
You can request a quote for 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butyric acid, (2S,3S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.