Chemical ID: 3936558

C#CC(=O)N(c1cccc(c1)C(F)(F)F)C(c2ccc(cc2)F)C(=O)NC3CCCC3
Chemical ID:
3936558
Name [?]:
N-[cyclopentylcarbamoyl-(4-fluorophenyl)-methyl]-N-[3-(trifluoromethyl)phenyl]-prop-2-ynamide
SMILES [?]:
C#CC(=O)N(c1cccc(c1)C(F)(F)F)C(c2ccc(cc2)F)C(=O)NC3CCCC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H20F4N2O2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:9.89086
Area:601.448
Solvation:-5.14534
Coulombic:-64.8995
Bond Count [?]
All:33
Single:24
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:432.411
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.78
LogP (Chemaxon):4.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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