2-chloro-4-((1R,2R)-2-hydroxy-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propylamino)-3-methylbenzonitrile

HCID 67006203

Basic information

Standard SMILES
Cc1c(N[C@@H](c2nc(-c3ccccc3)no2)[C@@H](C)O)ccc(C#N)c1Cl
InChIKey
GEBRCEDIBHJTAL-SJKOYZFVSA-N
Molecular formula
C19H17ClN4O2
Average molar mass
368.8 g/mol

Names & identifiers

Preferred name
2-chloro-4-((1R,2R)-2-hydroxy-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propylamino)-3-methylbenzonitrile
IUPAC
2-chloro-4-[[(1R,2R)-2-hydroxy-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]amino]-3-methylbenzonitrile

Names & synonyms

SCHEMBL1363778GEBRCEDIBHJTAL-SJKOYZFVSA-NBDBM112884US8629167, 182-chloro-4-((1R,2R)-2-hydroxy-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propylamino)-3-methylbenzonitrile

Database identifiers

PubChem CID
67006203

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
95 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

Related reactions

4 records

Linked notes

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