Chemical ID: 4460675

CCc1ccc(cc1)n2c(nnc2SCC(=O)Nc3ccc(cc3)OC)C
Chemical ID:
4460675
Name [?]:
2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-acetamide
SMILES [?]:
CCc1ccc(cc1)n2c(nnc2SCC(=O)Nc3ccc(cc3)OC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H22N4O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.3755
Area:622.004
Solvation:-4.17464
Coulombic:-38.9861
Bond Count [?]
All:29
Single:20
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:382.48
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.2
LogP (Chemaxon):3.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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