Basic information
- Standard SMILES
CCOC(=O)c1cc2cc(OC3CCN(C(C)C)CC3)ccc2n1-c1cncnc1- InChIKey
SXVUGSPXSXSOPL-UHFFFAOYSA-N- Molecular formula
- C23H28N4O3
- Average molar mass
- 408.5 g/mol
Names & identifiers
- Preferred name
- 5-(1-Isopropyl-piperidin-4-yloxy)-1-pyrimidin-5-yl-1H-indole-2-carboxylic acid ethyl ester
- IUPAC
- ethyl 5-(1-propan-2-ylpiperidin-4-yl)oxy-1-pyrimidin-5-ylindole-2-carboxylate
Names & synonyms
SCHEMBL1398006SXVUGSPXSXSOPL-UHFFFAOYSA-N5-(1-Isopropyl-piperidin-4-yloxy)-1-pyrimidin-5-yl-1H-indole-2-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 67017932
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 561
Related reactions
2 records
Compound notes
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