Basic information
- CAS
6314-73-4- Standard SMILES
Cc1ccc(S(=O)(=O)Nc2nnc(C(C)C)s2)cc1- InChIKey
RVZBTLZCOLGOHU-UHFFFAOYSA-N- Molecular formula
- C12H15N3O2S2
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.06056908
Names & identifiers
- Preferred name
- N-(5-Isopropyl-1,3,4-thiadiazol-2-yl)-p-toluenesulphonamide
- IUPAC
- 4-methyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
- English name
- N-[5-isopropyl-1,3,4-thiadiazol-2-yl]-p-toluenesulphonamide
- Molecular formula
- C12H15N3O2S2
- Molecular weight
- 297.4
Names & synonyms
6314-73-4UZ2BBG7NG7N-(5-Isopropyl-1,3,4-thiadiazol-2-yl)-p-toluenesulphonamideNSC-230094-METHYL-N-[5-(PROPAN-2-YL)-1,3,4-THIADIAZOL-2-YL]BENZENE-1-SULFONAMIDEN-(5-Isopropyl-1,3,4-thiadiazol-2-yl)-p-toluenesulfonamide4-Methyl-N-[5-(1-methylethyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide4-METHYL-N-(5-(1-METHYLETHYL)-1,3,4-THIADIAZOL-2-YL)BENZENESULFONAMIDE4-methyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamideNSC23009EINECS 228-641-3n-(5-isopropyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
Show more names
N-[5-Isopropyl-1,3,4-thiadiazol-2-yl]-p-toluenesulfonamideN-[5-isopropyl-1,3,4-thiadiazol-2-yl]-p-toluenesulphonamide4-Methyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)benzenesulfonamideBenzenesulfonamide, 4-methyl-N-[5-(1-methylethyl)-1,3,4-thiadiazol-2-yl]-
UNII-UZ2BBG7NG7SCHEMBL5398574SCHEMBL10920225SCHEMBL10920228DTXSID80212487RVZBTLZCOLGOHU-UHFFFAOYSA-NHMS5162C10NSC 23009
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- FDA UNII
- 2 BBG7NG7 · UZ2BBG7NG7
Chemistry & industry
Suppliers1 total
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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