Chemical ID: 6608309

c1ccc(c(c1)c2nnc(n2C3CC3)SCC(=O)Nc4ccc(cc4)I)F
Chemical ID:
6608309
Name [?]:
2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodophenyl)-acetamide
SMILES [?]:
c1ccc(c(c1)c2nnc(n2C3CC3)SCC(=O)Nc4ccc(cc4)I)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H16FIN4OS
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.4486
Area:611.871
Solvation:-3.84817
Coulombic:-37.0322
Bond Count [?]
All:30
Single:21
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:494.326
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.3
LogP (Chemaxon):4.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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