Basic information
- Standard SMILES
COCc1cc(=O)nc2n1C[C@@H](COc1ccc(C(C)(C)C)cc1)O2- InChIKey
MXFJMCZFVZOVAN-INIZCTEOSA-N- Molecular formula
- C19H24N2O4
- Average molar mass
- 344.4 g/mol
Names & identifiers
- Preferred name
- (S)-2-(4-tert-Butyl-phenoxymethyl)-5-methoxymethyl-2,3-dihydro-oxazolo[3,2-a]pyrimidin-7-one
- IUPAC
- (2S)-2-[(4-tert-butylphenoxy)methyl]-5-(methoxymethyl)-2,3-dihydro-[1,3]oxazolo[3,2-a]pyrimidin-7-one
Names & synonyms
SCHEMBL3138515MXFJMCZFVZOVAN-INIZCTEOSA-N(S)-2-(4-tert-Butyl-phenoxymethyl)-5-methoxymethyl-2,3-dihydro-oxazolo[3,2-a]pyrimidin-7-one
Database identifiers
- PubChem CID
- 59252522
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 556
Related reactions
1 records
Compound notes
Loading…