6-[1-(1,1-Dioxo-1,3-thiazolidin-3-yl)-3-methyl-1-oxobutan-2-yl]-9-fluoro-2,6,11-triazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-5-one
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC(C)C(C(=O)N1CCS(=O)(=O)C1)N1Cc2c(F)cnc3[nH]cc(c23)C1=O- InChIKey
MMXQYNXAGRJQPI-UHFFFAOYSA-N- Molecular formula
- C17H19FN4O4S
- Average molar mass
- 394.4 g/mol
Names & identifiers
- Preferred name
- 6-[1-(1,1-Dioxo-1,3-thiazolidin-3-yl)-3-methyl-1-oxobutan-2-yl]-9-fluoro-2,6,11-triazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-5-one
- IUPAC
- 6-[1-(1,1-dioxo-1,3-thiazolidin-3-yl)-3-methyl-1-oxobutan-2-yl]-9-fluoro-2,6,11-triazatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-5-one
Database identifiers
- PubChem CID
- 75301596
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 740
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Related reactions
1 records
Compound notes
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