Chemical ID: 5701861

CNC(=O)CSc1nnc(n1C2CCCCC2)c3ccc(cc3Cl)Cl
Chemical ID:
5701861
Name [?]:
2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide
SMILES [?]:
CNC(=O)CSc1nnc(n1C2CCCCC2)c3ccc(cc3Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H20Cl2N4OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.1955
Area:595.399
Solvation:-2.68946
Coulombic:-34.6557
Bond Count [?]
All:27
Single:21
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:399.338
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.04
LogP (Chemaxon):3.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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