3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid
TL;DR: 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid (CAS 799770-69-7) is a chemical compound with molecular formula C9H13N3O4S2 and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-carboxyethyl-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)amino]propanoic acid
Also Known As: 3-[2-carboxyethyl-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)amino]propanoic Acid, 3,3'-((5-(methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid, 3-[(2-CARBOXYETHYL)[5-(METHYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]AMINO]PROPANOIC ACID, 3,3'-{[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]imino}dipropanoic acid (non-preferred name)
| Molecular Formula | C9H13N3O4S2 |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 1.0158 |
| Topological Polar Surface Area | 103.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 291.03476 |
| Heavy Atoms | 18 |
| Complexity | 405.70016 |
Chemical Identifiers
| CAS Number | 799770-69-7 |
|---|---|
| SMILES | CSC1=NN=C(S1)N(CCC(=O)O)CCC(=O)O |
Product Overview
3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid (CAS 799770-69-7), with molecular formula C9H13N3O4S2 and molecular weight 291.03 g/mol. IUPAC: 3-[2-carboxyethyl-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)amino]propanoic acid.
Chemical Property Profile of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid
Property Insights of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid
The XLogP value of 1.0158 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid. The TPSA of 103.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid. Following Lipinski's Rule of Five, 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid has 2 hydrogen bond donor(s) and 7 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 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid?
The CAS number of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid is 799770-69-7.
What is the molecular formula of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid?
The molecular formula of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid is C9H13N3O4S2.
What is the molecular weight of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid?
The molecular weight of 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid is 291.03 g/mol.
Where can I buy 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid?
You can request a quote for 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-((5-(Methylthio)-1,3,4-thiadiazol-2-yl)azanediyl)dipropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.