Basic information
- Standard SMILES
CCCOc1nc(S(C)(=O)=O)nc2oc(-c3cc(C)c(OCC(=O)OC(C)(C)C)c(C)c3)nc12- InChIKey
IGAVEKHFGXETOG-UHFFFAOYSA-N- Molecular formula
- C23H29N3O7S
- Average molar mass
- 491.6 g/mol
Names & identifiers
- Preferred name
- Tert-butyl [4-(5-methanesulfonyl-7-propoxyoxazolo[5,4-d]pyrimidin-2-yl)-2,6-dimethylphenoxy]acetate
- IUPAC
- tert-butyl 2-[2,6-dimethyl-4-(5-methylsulfonyl-7-propoxy-[1,3]oxazolo[5,4-d]pyrimidin-2-yl)phenoxy]acetate
Names & synonyms
SCHEMBL14798080IGAVEKHFGXETOG-UHFFFAOYSA-N[4-(5-methanesulfonyl-7-propoxy-oxazolo[5,4-d]pyrimidin-2-yl)-2,6-dimethyl-phenoxy]-acetic acid tert-butyl estertert-butyl [4-(5-methanesulfonyl-7-propoxyoxazolo[5,4-d]pyrimidin-2-yl)-2,6-dimethylphenoxy]acetate
Database identifiers
- PubChem CID
- 86679896
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 785
Related reactions
6 records
Compound notes
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