Chemical ID: 5981443

c1ccc(cc1)c2cc(n(n2)c3ccc(cc3)F)C(=O)NC4CCCCNC4=O
Chemical ID:
5981443
Name [?]:
2-(4-fluorophenyl)-N-(2-oxoazepan-3-yl)-5-phenyl-pyrazole-3-carboxamide
SMILES [?]:
c1ccc(cc1)c2cc(n(n2)c3ccc(cc3)F)C(=O)NC4CCCCNC4=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H21FN4O2
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:10.255
Area:596.327
Solvation:-4.65322
Coulombic:-53.4299
Bond Count [?]
All:32
Single:22
Double:10
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:392.426
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.17
LogP (Chemaxon):2.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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