Chemical ID: 3855717

Cc1cccc(c1)NC(=O)CSc2nnc(n2C)COc3cccc(c3)OC
Chemical ID:
3855717
Name [?]:
2-[[5-[(3-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(m-tolyl)acetamide
SMILES [?]:
Cc1cccc(c1)NC(=O)CSc2nnc(n2C)COc3cccc(c3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H22N4O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.3397
Area:645.222
Solvation:-5.79081
Coulombic:-46.8694
Bond Count [?]
All:30
Single:21
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:398.48
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.56
LogP (Chemaxon):3.0

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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