Chemical ID: 5298102

CCOc1ccc(cc1)n2c(nnc2SCc3cccc(c3)OC)c4ccccc4
Chemical ID:
5298102
Name [?]:
4-(4-ethoxyphenyl)-3-[(3-methoxyphenyl)methylsulfanyl]-5-phenyl-1,2,4-triazole
SMILES [?]:
CCOc1ccc(cc1)n2c(nnc2SCc3cccc(c3)OC)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H23N3O2S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.2466
Area:656.808
Solvation:-4.17362
Coulombic:-30.4196
Bond Count [?]
All:33
Single:22
Double:11
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:417.524
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:7.32
LogP (Chemaxon):5.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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