Chemical ID: 3855718

CC(=O)c1ccc(cc1)NC(=O)CSc2nnc(n2C)COc3cccc(c3)OC
Chemical ID:
3855718
Name [?]:
N-(4-acetylphenyl)-2-[[5-[(3-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CC(=O)c1ccc(cc1)NC(=O)CSc2nnc(n2C)COc3cccc(c3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H22N4O4S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:10.1941
Area:682.455
Solvation:-6.86728
Coulombic:-53.5189
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:3.97
LogP (Chemaxon):1.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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