Chemical ID: 5157419

Cc1cc(cc(c1)NC(=O)CSc2nnc(n2C)COc3ccccc3OC)C
Chemical ID:
5157419
Name [?]:
N-(3,5-dimethylphenyl)-2-[[5-[(2-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
Cc1cc(cc(c1)NC(=O)CSc2nnc(n2C)COc3ccccc3OC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24N4O3S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.0593
Area:664.607
Solvation:-6.55584
Coulombic:-46.7138
Bond Count [?]
All:31
Single:22
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:412.506
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.73
LogP (Chemaxon):3.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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