Chemical ID: 5431041

Cc1ccc(c(c1)n2c(nnc2SCC(=O)c3ccc(cc3)OC(F)F)c4ccccc4Cl)C
Chemical ID:
5431041
Name [?]:
2-[[5-(2-chlorophenyl)-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-[4-(difluoromethoxy)phenyl]-ethanone
SMILES [?]:
Cc1ccc(c(c1)n2c(nnc2SCC(=O)c3ccc(cc3)OC(F)F)c4ccccc4Cl)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H20ClF2N3O2S
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:12.6174
Area:690.621
Solvation:-4.64811
Coulombic:-42.4971
Bond Count [?]
All:37
Single:25
Double:12
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:499.961
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:8.6
LogP (Chemaxon):6.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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