Basic information
- Standard SMILES
CC(C)(C(N)=O)N1CCN(Cc2cc3nc(-c4c[nH]c5cnccc45)nc(N4CCOCC4)c3s2)CC1- InChIKey
QBRIDOMSEPOYPJ-UHFFFAOYSA-N- Molecular formula
- C26H32N8O2S
- Average molar mass
- 520.7 g/mol
Names & identifiers
- Preferred name
- 2-methyl-2-(4-((4-morpholino-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)thieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)propanamide
- IUPAC
- 2-methyl-2-[4-[[4-morpholin-4-yl-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)thieno[3,2-d]pyrimidin-6-yl]methyl]piperazin-1-yl]propanamide
Names & synonyms
SCHEMBL2111303QBRIDOMSEPOYPJ-UHFFFAOYSA-N2-methyl-2-(4-((4-morpholino-2-(1H-pyrrolo[2,3-c]pyridin-3-yl)thieno[3,2-d]pyrimidin-6-yl)methyl)piperazin-1-yl)propanamide
Database identifiers
- PubChem CID
- 59603430
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 805
Related reactions
1 records
Compound notes
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