Chemical ID: 5309742

Cc1ccc(cc1)CSc2[nH]c(nn2)Cc3ccc(cc3)OC
Chemical ID:
5309742
Name [?]:
3-[(4-methoxyphenyl)methyl]-5-(p-tolylmethylsulfanyl)-4H-1,2,4-triazole
SMILES [?]:
Cc1ccc(cc1)CSc2[nH]c(nn2)Cc3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H19N3OS
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.7246
Area:558.322
Solvation:-3.2335
Coulombic:-25.524
Bond Count [?]
All:25
Single:17
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.429
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.36
LogP (Chemaxon):4.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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