3-Methylthio-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)propan-2-ol

HCID 20205892
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Basic information

Standard SMILES
CSCC(O)(Cn1cncn1)c1ccc(Cl)cc1Cl
InChIKey
SPUDWFPZXVXCKV-UHFFFAOYSA-N
Molecular formula
C12H13Cl2N3OS
Average molar mass
318.2 g/mol

Names & identifiers

Preferred name
3-Methylthio-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)propan-2-ol
IUPAC
2-(2,4-dichlorophenyl)-1-methylsulfanyl-3-(1,2,4-triazol-1-yl)propan-2-ol

Names & synonyms

SCHEMBL10802527SPUDWFPZXVXCKV-UHFFFAOYSA-N3-Methylthio-2-(2,4-dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)propan-2-ol

Database identifiers

PubChem CID
20205892

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
76.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19

Related reactions

1 records
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Compound notes

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