N-(2''-(Dimethylamino)ethyl)-4,6-dithien-2'-ylpyrimidin-2-amine dihydrobromide
Basic information
- CAS
119184-15-5- Standard SMILES
Br.Br.CN(C)CCNc1nc(-c2ccsc2)cc(-c2cccs2)n1- InChIKey
VNSBETFSXAXSFJ-UHFFFAOYSA-N- Molecular formula
- C16H20Br2N4S2
- Average molar mass
- 492.3 g/mol
- Monoisotopic mass
- 489.94961
Names & identifiers
- Preferred name
- N-(2''-(Dimethylamino)ethyl)-4,6-dithien-2'-ylpyrimidin-2-amine dihydrobromide
- IUPAC
- N',N'-dimethyl-N-(4-thiophen-2-yl-6-thiophen-3-ylpyrimidin-2-yl)ethane-1,2-diamine;dihydrobromide
Names & synonyms
N-(2''-(Dimethylamino)ethyl)-4,6-dithien-2'-ylpyrimidin-2-amine dihydrobromide
Database identifiers
- CAS
119184-15-5- PubChem CID
- 147457
Properties
Computed structural properties
- Topological polar surface area
- 97.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 342
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