Chemical ID: 5132778

Cc1cc(cc(c1)NC(=O)CSc2nnc(n2C)C3CCCCC3)C
Chemical ID:
5132778
Name [?]:
2-[(5-cyclohexyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,5-dimethylphenyl)-acetamide
SMILES [?]:
Cc1cc(cc(c1)NC(=O)CSc2nnc(n2C)C3CCCCC3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H26N4OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.0602
Area:592.9
Solvation:-2.76229
Coulombic:-32.5713
Bond Count [?]
All:27
Single:21
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:358.502
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.6
LogP (Chemaxon):4.1

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue