Chemical ID: 5308466

CCn1c(nnc1SCC(=O)N)c2ccc(cc2)OC
Chemical ID:
5308466
Name [?]:
2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)N)c2ccc(cc2)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H16N4O2S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.25855
Area:488.401
Solvation:-3.95149
Coulombic:-44.341
Bond Count [?]
All:21
Single:15
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:292.358
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.78
LogP (Chemaxon):0.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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