3-methyl-1,2,4-thiadiazol-5-amine - CAS 17467-35-5
Catalog: |
BB013035 |
Product Name: |
3-methyl-1,2,4-thiadiazol-5-amine |
CAS: |
17467-35-5 |
Synonyms: |
3-methyl-1,2,4-thiadiazol-5-amine; 3-methyl-1,2,4-thiadiazol-5-amine |
IUPAC Name: | 3-methyl-1,2,4-thiadiazol-5-amine |
Description: | 3-methyl-1,2,4-thiadiazol-5-amine (CAS# 17467-35-5) is a useful intermediate used in the preparation of 1,2,4-thiadiazole analogue that functions as a non-peptide inhibitor of beta-secretase. |
Molecular Weight: | 115.154 |
Molecular Formula: | C3H5N3S |
Canonical SMILES: | CC1=NSC(=N1)N |
InChI: | InChI=1S/C3H5N3S/c1-2-5-3(4)7-6-2/h1H3,(H2,4,5,6) |
InChI Key: | DJKUIGPCSNRFRK-UHFFFAOYSA-N |
Boiling Point: | 261.2 ℃ at 760 mmHg |
Density: | 1.372 g/cm3 |
MDL: | MFCD01114751 |
LogP: | 1.00990 |
GHS Hazard Statement: | H302 (99.22%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111635377-A | Thiadiazole compound and synthesis method thereof | 20200630 |
CN-112279853-A | Selective JAK1 inhibitor compound and preparation method and application thereof | 20190723 |
WO-2020128003-A1 | SYNTHESIS OF 3-METHYL-1,2,4-THIADIAZOLE-5-CARBOHYDRAZIDE OR OF THE METHYL-d3 DEUTERATED FORM THEREOF | 20181221 |
KR-20210106528-A | Synthesis of 3-methyl-1,2,4-thiadiazole-5-carbohydrazide or its methyl-d3 deuterated form | 20181221 |
AU-2018238079-A1 | Novel pyridone carboxylic acid derivative or salt thereof | 20170324 |
Complexity: | 67.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 115.02041835 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 115.02041835 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 80 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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