Chemical ID: 4459841

Cc1cccc(c1)n2c(nnc2SCC(=O)Nc3ccc(c(c3)Cl)F)Cc4ccccc4
Chemical ID:
4459841
Name [?]:
2-[[5-benzyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chloro-4-fluoro-phenyl)-acetamide
SMILES [?]:
Cc1cccc(c1)n2c(nnc2SCC(=O)Nc3ccc(c(c3)Cl)F)Cc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H20ClFN4OS
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:13.1387
Area:686.819
Solvation:-4.03179
Coulombic:-37.6502
Bond Count [?]
All:35
Single:23
Double:12
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:466.959
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:7.13
LogP (Chemaxon):5.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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