2-[4,5-dihydro-1H-imidazol-2-yl-(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-methoxyphenyl)ethanone
Basic information
- Standard SMILES
COc1ccc(C(=O)CN(C2=NCCN2)c2nnc(C)s2)cc1- InChIKey
CHAPNFPRVQTHGW-UHFFFAOYSA-N- Molecular formula
- C15H17N5O2S
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.11029598
Names & identifiers
- Preferred name
- 2-[4,5-dihydro-1H-imidazol-2-yl-(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-methoxyphenyl)ethanone
- IUPAC
- 2-[4,5-dihydro-1H-imidazol-2-yl-(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-methoxyphenyl)ethanone
Names & synonyms
2-[4,5-dihydro-1H-imidazol-2-yl-(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-methoxyphenyl)ethanoneDTXSID001384497
Database identifiers
- PubChem CID
- 50564
- DTXSID
DTXSID001384497
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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