5-(Boc-amino)-1,2,4-thiadiazole - CAS 264600-76-2
Catalog: |
BB019293 |
Product Name: |
5-(Boc-amino)-1,2,4-thiadiazole |
CAS: |
264600-76-2 |
Synonyms: |
N-(1,2,4-thiadiazol-5-yl)carbamic acid tert-butyl ester; tert-butyl N-(1,2,4-thiadiazol-5-yl)carbamate |
IUPAC Name: | tert-butyl N-(1,2,4-thiadiazol-5-yl)carbamate |
Description: | 5-(Boc-amino)-1,2,4-thiadiazole (CAS# 264600-76-2) is a useful research chemical. |
Molecular Weight: | 201.25 |
Molecular Formula: | C7H11N3O2S |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=NC=NS1 |
InChI: | InChI=1S/C7H11N3O2S/c1-7(2,3)12-6(11)10-5-8-4-9-13-5/h4H,1-3H3,(H,8,9,10,11) |
InChI Key: | HKRDLXVLFKXELZ-UHFFFAOYSA-N |
LogP: | 1.95810 |
Publication Number | Title | Priority Date |
CN-108778273-A | The method of aryl bicyclic monocycle beta-lactam compound and its purposes for treating bacterium infection | 20160307 |
CN-108368040-A | Diaryl monocycle beta-lactam compound and its method for treating bacterium infection | 20151215 |
CN-106164072-B | For treating the monobactam organic compound of bacterium infection | 20140324 |
EA-030850-B1 | ORGANIC COMPOUNDS, MONOBACTAMA, FOR THE TREATMENT OF BACTERIAL INFECTIONS | 20140324 |
NZ-723114-A | Monobactam organic compounds for the treatment of bacterial infections | 20140324 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.05719778 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.05719778 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 92.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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