Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester
TL;DR: Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester (CAS 64145-14-8) is a chemical compound with molecular formula C12H12N2O4S2 and molecular weight 312.02383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl]acetate
Also Known As: L 1545, 4-27-00-07343 (Beilstein Handbook Reference), ACETIC ACID, ((5-PHENYL-1,3,4-THIADIAZOL-2-YL)SULFONYL)-, ETHYL ESTER, (5-Fenil-1,3,4-tiadiazol-2-ilsulfonil)-acetato etilico, L-1545
Technical Specifications
| Molecular Formula | C12H12N2O4S2 |
| Molecular Weight | 312.02383 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.02383 Da |
| Heavy Atoms | 20 |
| Complexity | 429.0 |
| SMILES | CCOC(=O)CS(=O)(=O)C1=NN=C(S1)C2=CC=CC=C2 |
| InChIKey | JAIIRUBKMWLGHL-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester
Property Insights of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester?
The CAS number of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester is 64145-14-8.
What is the molecular formula of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester?
The molecular formula of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester is C12H12N2O4S2.
What is the molecular weight of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester?
The molecular weight of Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester is 312.02383 g/mol.
Where can I buy Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester?
You can request a quote for Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, ((5-phenyl-1,3,4-thiadiazol-2-yl)sulfonyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.