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Basic information
- Standard SMILES
CCOC(=O)N1CC(Nc2nc(CC)c(-c3ccc(Cl)cc3Cl)nc2CC)C(OCC)C1- InChIKey
ZRWUSVTYMZIFTB-UHFFFAOYSA-N- Molecular formula
- C23H30Cl2N4O3
- Average molar mass
- 481.4 g/mol
- Monoisotopic mass
- 480.1694962
Names & identifiers
- Preferred name
- Ethyl 3-[[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino]-4-ethoxypyrrolidine-1-carboxylate
- IUPAC
- ethyl 3-[[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino]-4-ethoxypyrrolidine-1-carboxylate
Database identifiers
- PubChem CID
- 22147366
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 76.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 602
Related reactions
2 records
Compound notes
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