Chemical ID: 5991297

Cc1ccc(c(c1)C)n2c(cc(n2)c3ccc(cc3)[N+](=O)[O-])C(=O)NC(C)(C)C
Chemical ID:
5991297
Name [?]:
2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)-N-tert-butyl-pyrazole-3-carboxamide
SMILES [?]:
Cc1ccc(c(c1)C)n2c(cc(n2)c3ccc(cc3)[N+](=O)[O-])C(=O)NC(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H24N4O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:7.48153
Area:603.628
Solvation:-7.60916
Coulombic:-40.6196
Bond Count [?]
All:31
Single:21
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:392.451
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.17
LogP (Chemaxon):4.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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