Completing data — usually done within a minute
Basic information
- CAS
57773-87-2- Standard SMILES
CCN1NCN(c2nnc(C)s2)C1=O- InChIKey
OJGHOLMUNBYDMW-UHFFFAOYSA-N- Molecular formula
- C7H11N5OS
- Average molar mass
- 213.26 g/mol
- Monoisotopic mass
- 213.06843116
Names & identifiers
- Preferred name
- 2-Ethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazolidin-3-one
- IUPAC
- 2-ethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazolidin-3-one
Names & synonyms
2-ethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazolidin-3-one57773-87-2SCHEMBL11704445DTXSID70614198OJGHOLMUNBYDMW-UHFFFAOYSA-N
Database identifiers
- CAS
57773-87-2- PubChem CID
- 21454610
- DTXSID
DTXSID70614198
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 238
Related reactions
3 records
Compound notes
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