Basic information
- CAS
6340-75-6- Standard SMILES
CCc1c(Nc2ccccc2C)[nH]c(N)nc1=S- InChIKey
ONAIURMFUNDKJP-UHFFFAOYSA-N- Molecular formula
- C13H16N4S
- Average molar mass
- 260.36 g/mol
- Monoisotopic mass
- 260.1095677
Names & identifiers
- Preferred name
- 2-amino-5-ethyl-6-(2-methylanilino)-1H-pyrimidine-4-thione
- IUPAC
- 2-amino-5-ethyl-6-(2-methylanilino)-1H-pyrimidine-4-thione
Names & synonyms
NSC510396340-75-6DTXSID90398367NSC-510392-Amino-5-ethyl-6-(2-methylanilino)pyrimidine-4(1H)-thione
Database identifiers
- CAS
6340-75-6- PubChem CID
- 3980896
- DTXSID
DTXSID90398367
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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