Chemical ID: 6190110

c1ccc(cc1)n2c(nnc2SCC(=O)Nc3ccc(cc3)F)CNC(=O)COc4ccccc4
Chemical ID:
6190110
Name [?]:
N-(4-fluorophenyl)-2-[[5-[(2-phenoxyacetyl)aminomethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
c1ccc(cc1)n2c(nnc2SCC(=O)Nc3ccc(cc3)F)CNC(=O)COc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H22FN5O3S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:11.9119
Area:754.775
Solvation:-6.95746
Coulombic:-64.923
Bond Count [?]
All:38
Single:25
Double:13
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:491.538
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.11
LogP (Chemaxon):3.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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