Basic information
- Standard SMILES
CC(C)(C)OC(=O)CNC(=O)c1cnc(N2CCc3ccccc32)nc1OCc1ccc(F)cc1- InChIKey
DVQLPBZQIGESSI-UHFFFAOYSA-N- Molecular formula
- C26H27FN4O4
- Average molar mass
- 478.5 g/mol
Names & identifiers
- Preferred name
- t-Butyl 2-[({2-(2,3-dihydro-1H-indol-1-yl)-4-[(4-fluorobenzyl)oxy]-5-pyrimidinyl}carbonyl)amino]acetate
- IUPAC
- tert-butyl 2-[[2-(2,3-dihydroindol-1-yl)-4-[(4-fluorophenyl)methoxy]pyrimidine-5-carbonyl]amino]acetate
Names & synonyms
SCHEMBL5752664DVQLPBZQIGESSI-UHFFFAOYSA-Nt-Butyl 2-[({2-(2,3-dihydro-1H-indol-1-yl)-4-[(4-fluorobenzyl)oxy]-5-pyrimidinyl}carbonyl)amino]acetate
Database identifiers
- PubChem CID
- 9912947
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 725
Related reactions
3 records
Compound notes
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