Chemical ID: 3843471

Cn1c(nnc1SCc2ccccc2)c3ccc(cc3)O
Chemical ID:
3843471
Name [?]:
4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenol
SMILES [?]:
Cn1c(nnc1SCc2ccccc2)c3ccc(cc3)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3OS
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.9566
Area:498.56
Solvation:-2.50739
Coulombic:-31.1803
Bond Count [?]
All:23
Single:15
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:297.376
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.1
LogP (Chemaxon):3.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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