Chemical ID: 3637859

Cc1ccc(cc1)CSc2[nH]nc(n2)c3ccccc3O
Chemical ID:
3637859
Name [?]:
2-[5-(p-tolylmethylsulfanyl)-1H-1,2,4-triazol-3-yl]phenol
SMILES [?]:
Cc1ccc(cc1)CSc2[nH]nc(n2)c3ccccc3O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3OS
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.1014
Area:506.085
Solvation:-2.55072
Coulombic:-36.0682
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:4.43
LogP (Chemaxon):5.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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