5-(2,4-Diethoxyphenyl)-1,3,4-thiadiazol-2-ylamine - CAS 887360-38-5
Catalog: |
BB062890 |
Product Name: |
5-(2,4-Diethoxyphenyl)-1,3,4-thiadiazol-2-ylamine |
CAS: |
887360-38-5 |
Synonyms: |
5-(2,4-diethoxyphenyl)-1,3,4-thiadiazol-2-amine; 5-(2,4-diethoxyphenyl)-1,3,4-thiadiazol-2-ylamine |
IUPAC Name: | 5-(2,4-diethoxyphenyl)-1,3,4-thiadiazol-2-amine |
Description: | 5-(2,4-Diethoxyphenyl)-1,3,4-thiadiazol-2-ylamine |
Molecular Weight: | 265.33 |
Molecular Formula: | C12H15N3O2S |
Canonical SMILES: | CCOC1=CC(=C(C=C1)C2=NN=C(S2)N)OCC |
InChI: | InChI=1S/C12H15N3O2S/c1-3-16-8-5-6-9(10(7-8)17-4-2)11-14-15-12(13)18-11/h5-7H,3-4H2,1-2H3,(H2,13,15) |
InChI Key: | GBEGUKWTZHDMAL-UHFFFAOYSA-N |
Complexity: | 258 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.0884979 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.0884979 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 98.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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