![Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate structure](/static/products/880/880417-65-2.png)
Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate
TL;DR: Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate (CAS 880417-65-2) is a chemical compound with molecular formula C12H13N3O3S2 and molecular weight 311.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
Also Known As: methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate, methyl 2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
| Molecular Formula | C12H13N3O3S2 |
|---|---|
| Molecular Weight | 311.04 g/mol |
| LogP | 2.5554 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 311.03983 |
| Heavy Atoms | 20 |
| Complexity | 588.8315 |
Chemical Identifiers
| CAS Number | 880417-65-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC2=NN=C(S2)SCC(=O)OC |
Product Overview
Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate (CAS 880417-65-2), with molecular formula C12H13N3O3S2 and molecular weight 311.04 g/mol. IUPAC: methyl 2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate
Property Insights of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate
The XLogP value of 2.5554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate. Following Lipinski's Rule of Five, Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate has 1 hydrogen bond donor(s) and 8 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 Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate?
The CAS number of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate is 880417-65-2.
What is the molecular formula of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate?
The molecular formula of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate is C12H13N3O3S2.
What is the molecular weight of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate?
The molecular weight of Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate is 311.04 g/mol.
Where can I buy Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate?
You can request a quote for Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-({5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.