Chemical ID: 4637260

Cc1c(c(nn1CC(=O)Nc2c(c3c(s2)CCCC3)C#N)C(F)(F)F)Cl
Chemical ID:
4637260
Name [?]:
2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-acetamide
SMILES [?]:
Cc1c(c(nn1CC(=O)Nc2c(c3c(s2)CCCC3)C#N)C(F)(F)F)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H14ClF3N4OS
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.2806
Area:569.521
Solvation:-3.95745
Coulombic:-46.8921
Bond Count [?]
All:28
Single:22
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:402.823
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.83
LogP (Chemaxon):3.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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