Basic information
- Standard SMILES
CC(C)Cn1c(=O)n(C)c(=O)c2c(C(=O)N3C[C@H](O)CO3)c(Cc3cnc4ccccn34)sc21- InChIKey
PHTPNKIHLRLMJH-HNNXBMFYSA-N- Molecular formula
- C23H25N5O5S
- Average molar mass
- 483.5 g/mol
- Monoisotopic mass
- 483.15764009
Names & identifiers
- Preferred name
- 5-[(4S)-4-Hydroxyisoxazolidin-2-ylcarbonyl]-6-(imidazo[1,2-a]pyridin-3-ylmethyl)-1-isobutyl-3-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
- IUPAC
- 5-[(4S)-4-hydroxy-1,2-oxazolidine-2-carbonyl]-6-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione
Names & synonyms
SCHEMBL3827050PHTPNKIHLRLMJH-HNNXBMFYSA-N5-[(4S)-4-Hydroxyisoxazolidin-2-ylcarbonyl]-6-(imidazo[1,2-a]pyridin-3-ylmethyl)-1-isobutyl-3-methylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Database identifiers
- PubChem CID
- 10299653
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 830
Related reactions
1 records
Compound notes
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