![2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid structure](/static/products/3453/345347-69-5.webp)
2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid
TL;DR: 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid (CAS 345347-69-5) is a chemical compound with molecular formula C13H17N3O3S2 and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid, 3-({[5-(ETHYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]AMINO}CARBONYL)BICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID, 3-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid, 3-({[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid, 3-[N-(5-ethylthio-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carb oxylic acid
| Molecular Formula | C13H17N3O3S2 |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 2.3355 |
| Topological Polar Surface Area | 92.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.07114 |
| Heavy Atoms | 21 |
| Complexity | 562.6113 |
Chemical Identifiers
| CAS Number | 345347-69-5 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2C3CCC(C3)C2C(=O)O |
Product Overview
2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid (CAS 345347-69-5), with molecular formula C13H17N3O3S2 and molecular weight 327.07 g/mol. IUPAC: 3-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid.
Chemical Property Profile of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid
Property Insights of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid
The XLogP value of 2.3355 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid. The TPSA of 92.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid. Following Lipinski's Rule of Five, 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic 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
Frequently Asked Questions
What is the CAS number of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?
The CAS number of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is 345347-69-5.
What is the molecular formula of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?
The molecular formula of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is C13H17N3O3S2.
What is the molecular weight of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?
The molecular weight of 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is 327.07 g/mol.
Where can I buy 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?
You can request a quote for 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.