Basic information
- Standard SMILES
CS(=O)(=O)N1CCN(Cc2cc3nc(-c4ccnc(N)c4)nc(N4CCOCC4)c3s2)CC1- InChIKey
KPKGXPGKYSNSLV-UHFFFAOYSA-N- Molecular formula
- C21H27N7O3S2
- Average molar mass
- 489.6 g/mol
Names & identifiers
- Preferred name
- 4-(4-morpholino-6-((4-N-methylsulfonylpiperazin-1-yl)methyl)thieno[3,2-d]pyrimidin-2-yl)pyridin-2-amine
- IUPAC
- 4-[6-[(4-methylsulfonylpiperazin-1-yl)methyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl]pyridin-2-amine
Names & synonyms
SCHEMBL1181228KPKGXPGKYSNSLV-UHFFFAOYSA-N4-(4-morpholino-6-((4-N-methylsulfonylpiperazin-1-yl)methyl)thieno[3,2-d]pyrimidin-2-yl)pyridin-2-amine4-(6-((4-(methylsulfonyl)piperazin-1-yl)methyl)-4-morpholinothieno[3,2-d]pyrimidin-2-yl)pyridin-2-amine
Database identifiers
- PubChem CID
- 24948355
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 755
Related reactions
7 records
Compound notes
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