Basic information
- Standard SMILES
O=C(O)CNC(=O)c1c(O)n(C2CCCCC2)c(=O)[nH]c1=O- InChIKey
KRONOEMBMKPKHU-UHFFFAOYSA-N- Molecular formula
- C13H17N3O6
- Average molar mass
- 311.29 g/mol
Names & identifiers
- Preferred name
- N-[(1-Cyclohexyl-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)carbonyl]glycine
- IUPAC
- 2-[(1-cyclohexyl-6-hydroxy-2,4-dioxopyrimidine-5-carbonyl)amino]acetic acid
Names & synonyms
SCHEMBL3422554SCHEMBL3920217KRONOEMBMKPKHU-UHFFFAOYSA-NN-[(1-Cyclohexyl-6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)carbonyl]glycine
Database identifiers
- PubChem CID
- 59313199
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 550
Related reactions
3 records
Compound notes
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