Chemical ID: 5554194

CC(=C)CSc1nnc(n1c2ccccc2)c3ccc(cc3)OC
Chemical ID:
5554194
Name [?]:
3-(4-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazole
SMILES [?]:
CC(=C)CSc1nnc(n1c2ccccc2)c3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H19N3OS
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.0756
Area:546.833
Solvation:-2.59519
Coulombic:-23.6588
Bond Count [?]
All:26
Single:17
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:337.44
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.74
LogP (Chemaxon):4.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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