Chemical ID: 5978007

c1cc(sc1)C(=O)NCc2nnc(n2c3cc(ccc3Cl)Cl)SCc4ccc(cc4)F
Chemical ID:
5978007
Name [?]:
N-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide
SMILES [?]:
c1cc(sc1)C(=O)NCc2nnc(n2c3cc(ccc3Cl)Cl)SCc4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H15Cl2FN4OS2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:14.2006
Area:704.206
Solvation:-3.40455
Coulombic:-41.2397
Bond Count [?]
All:34
Single:23
Double:11
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:493.406
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.67
LogP (Chemaxon):4.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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