Chemical ID: 5607469

c1cc(ccc1OCCSc2[nH]c(nn2)N)Cl
Chemical ID:
5607469
Name [?]:
5-[2-(4-chlorophenoxy)ethylsulfanyl]-4H-1,2,4-triazol-3-amine
SMILES [?]:
c1cc(ccc1OCCSc2[nH]c(nn2)N)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H11ClN4OS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.19996
Area:469.504
Solvation:-2.53764
Coulombic:-42.2331
Bond Count [?]
All:18
Single:13
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:270.739
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:3.76
LogP (Chemaxon):2.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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