(1S,2S)-1-{[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino}-2,3-dihydro-1H-inden-2-ol
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Basic information
- Standard SMILES
CCc1nc(-c2ccc(Cl)cc2Cl)c(CC)nc1N[C@H]1c2ccccc2C[C@@H]1O- InChIKey
GQPITAIWQNLKFV-UNMCSNQZSA-N- Molecular formula
- C23H23Cl2N3O
- Average molar mass
- 428.4 g/mol
Names & identifiers
- Preferred name
- (1S,2S)-1-{[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino}-2,3-dihydro-1H-inden-2-ol
- IUPAC
- (1S,2S)-1-[[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino]-2,3-dihydro-1H-inden-2-ol
Names & synonyms
SCHEMBL3839450GQPITAIWQNLKFV-UNMCSNQZSA-N(1S,2 S)-1-{[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino}-2,3-dihydro-1H-inden-2-ol(1S,2S)-1-{[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]amino}-2,3-dihydro-1H-inden-2-ol
Database identifiers
- PubChem CID
- 58583293
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 538
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Related reactions
8 records
Compound notes
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