Chemical ID: 5463013

Cn1c(nnc1SCC(=O)c2ccc(cc2)OC)CC(=O)Nc3ccccc3OC
Chemical ID:
5463013
Name [?]:
N-(2-methoxyphenyl)-2-[5-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-acetamide
SMILES [?]:
Cn1c(nnc1SCC(=O)c2ccc(cc2)OC)CC(=O)Nc3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H22N4O4S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:9.86774
Area:667.94
Solvation:-6.83077
Coulombic:-53.1946
Bond Count [?]
All:32
Single:22
Double:10
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:426.49
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.79
LogP (Chemaxon):2.16

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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