Chemical ID: 4238837

Cc1cccc(c1NC(=O)CSc2[nH]c(nn2)C)C
Chemical ID:
4238837
Name [?]:
N-(2,6-dimethylphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
SMILES [?]:
Cc1cccc(c1NC(=O)CSc2[nH]c(nn2)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H16N4OS
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.93133
Area:475.135
Solvation:-2.94706
Coulombic:-35.1456
Bond Count [?]
All:20
Single:14
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:276.358
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.96
LogP (Chemaxon):0.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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