Chemical ID: 5410218

Cc1ccc(c(c1)C)OCc2nnc(n2C)SCC(=O)Nc3ccccc3Cl
Chemical ID:
5410218
Name [?]:
N-(2-chlorophenyl)-2-[[5-[(2,4-dimethylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
Cc1ccc(c(c1)C)OCc2nnc(n2C)SCC(=O)Nc3ccccc3Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H21ClN4O2S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.4089
Area:659.44
Solvation:-4.07706
Coulombic:-41.4674
Bond Count [?]
All:30
Single:21
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:416.925
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.5
LogP (Chemaxon):3.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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