(1R,2S)-1-({5-[2-chloro-4-(dimethylamino)phenyl]-3,6-diethylpyrazin-2-yl}amino)-2,3-dihydro-1H-inden-2-ol

HCID 58583286
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Basic information

Standard SMILES
CCc1nc(-c2ccc(N(C)C)cc2Cl)c(CC)nc1N[C@@H]1c2ccccc2C[C@@H]1O
InChIKey
GAUCSLIPTNXWJV-LADGPHEKSA-N
Molecular formula
C25H29ClN4O
Average molar mass
437 g/mol

Names & identifiers

Preferred name
(1R,2S)-1-({5-[2-chloro-4-(dimethylamino)phenyl]-3,6-diethylpyrazin-2-yl}amino)-2,3-dihydro-1H-inden-2-ol
IUPAC
(1R,2S)-1-[[5-[2-chloro-4-(dimethylamino)phenyl]-3,6-diethylpyrazin-2-yl]amino]-2,3-dihydro-1H-inden-2-ol

Names & synonyms

SCHEMBL3840881GAUCSLIPTNXWJV-LADGPHEKSA-N(1R,2S)-1-({5-[2-chloro-4-(dimethylamino)phenyl]-3,6-diethylpyrazin-2-yl}amino)-2,3-dihydro-1H-inden-2-ol

Database identifiers

PubChem CID
58583286

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
61.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
31

Related reactions

5 records
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Compound notes

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