Chemical ID: 5304430

CCOc1ccc(cc1)n2c(nnc2SCc3ccccc3C)c4ccccc4
Chemical ID:
5304430
Name [?]:
4-(4-ethoxyphenyl)-3-(o-tolylmethylsulfanyl)-5-phenyl-1,2,4-triazole
SMILES [?]:
CCOc1ccc(cc1)n2c(nnc2SCc3ccccc3C)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H23N3OS
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:13.0907
Area:634.87
Solvation:-2.78104
Coulombic:-24.0004
Bond Count [?]
All:32
Single:21
Double:11
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:401.525
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:7.84
LogP (Chemaxon):6.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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