Chemical ID: 4630530

CCc1nnc(n1N)SCC(=O)Nc2ccc(c(c2)Cl)Cl
Chemical ID:
4630530
Name [?]:
2-[(4-amino-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,4-dichlorophenyl)-acetamide
SMILES [?]:
CCc1nnc(n1N)SCC(=O)Nc2ccc(c(c2)Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H13Cl2N5OS
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.2809
Area:542.555
Solvation:-3.28295
Coulombic:-42.025
Bond Count [?]
All:22
Single:16
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:346.236
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.37
LogP (Chemaxon):2.16

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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