Chemical ID: 5778621

C=CCNS(=O)(=O)c1[nH]cnn1
Chemical ID:
5778621
Name [?]:
N-allyl-4H-1,2,4-triazole-3-sulfonamide
SMILES [?]:
C=CCNS(=O)(=O)c1[nH]cnn1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C5H8N4O2S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.33124
Area:345.138
Solvation:-2.29721
Coulombic:-30.5988
Bond Count [?]
All:12
Single:7
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:188.209
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.52
LogP (Chemaxon):-1.14

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue