Basic information
- Standard SMILES
CC(C)Cn1c(=O)n(C)c(=O)c2cc(C3OC(=N)c4ccccc43)sc21- InChIKey
RVMKJQGAPYJIDF-UHFFFAOYSA-N- Molecular formula
- C19H19N3O3S
- Average molar mass
- 369.4 g/mol
- Monoisotopic mass
- 369.11471265
Names & identifiers
- Preferred name
- 6-(3-Imino-1,3-dihydro-benzo[c]furan-1-yl)-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
- IUPAC
- 6-(3-imino-1H-2-benzofuran-1-yl)-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione
Names & synonyms
SCHEMBL5865269RVMKJQGAPYJIDF-UHFFFAOYSA-N6-(3-imino-1,3-dihydro-benzo[c]furan-1-yl)-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1h, 3h)-dione6-(3-Imino-1,3-dihydro-benzo[c]furan-1-yl)-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Database identifiers
- PubChem CID
- 22258043
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 625
Related reactions
3 records
Compound notes
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