Basic information
- Standard SMILES
CC1(C)C(=O)NC(=O)N1CCNc1ncc(Br)c(-c2cc3cc(N)ccc3s2)n1- InChIKey
IMISXJRNEMENMW-UHFFFAOYSA-N- Molecular formula
- C19H19BrN6O2S
- Average molar mass
- 475.4 g/mol
Names & identifiers
- Preferred name
- 1-(2-(4-(5-Aminobenzo[b]thiophen-2-yl)-5-bromopyrimidin-2-ylamino)ethyl)-5,5-dimethylimidazolidine-2,4-dione
- IUPAC
- 1-[2-[[4-(5-amino-1-benzothiophen-2-yl)-5-bromopyrimidin-2-yl]amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
Names & synonyms
SCHEMBL2986248IMISXJRNEMENMW-UHFFFAOYSA-N1-(2-(4-(5-Aminobenzo[b]thiophen-2-yl)-5-bromopyrimidin-2-ylamino)ethyl)-5,5-dimethylimidazolidine-2,4-dione
Database identifiers
- PubChem CID
- 11634276
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 652
Related reactions
3 records
Compound notes
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