Chemical ID: 3843543

Cn1c(nnc1SCCN2CCCCC2)c3ccccc3OC
Chemical ID:
3843543
Name [?]:
1-[2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethyl]piperidine
SMILES [?]:
Cn1c(nnc1SCCN2CCCCC2)c3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H24N4OS
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.2997
Area:550.434
Solvation:-3.46113
Coulombic:-25.6407
Bond Count [?]
All:25
Single:20
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:332.465
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.62
LogP (Chemaxon):2.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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