2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide
Basic information
- CAS
554426-46-9- Standard SMILES
CC(C)(C)NC(=O)NC(=O)CSc1nnc(N)s1- InChIKey
BLXQEKRNXRCLCE-UHFFFAOYSA-N- Molecular formula
- C9H15N5O2S2
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.06671709
Names & identifiers
- Preferred name
- 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide
- IUPAC
- 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide
Names & synonyms
DTXSID401125150AKOS0024755692-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide2-[(5-Amino-1,3,4-thiadiazol-2-yl)thio]-N-[[(1,1-dimethylethyl)amino]carbonyl]acetamide554426-46-9SR-01000043506SR-01000043506-1Z18451571
Database identifiers
- CAS
554426-46-9- PubChem CID
- 2467380
- DTXSID
DTXSID401125150
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
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Compound notes
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