Chemical ID: 5991624

COc1ccc(c(c1)OC)c2cc(n(n2)c3ccc(cc3)[N+](=O)[O-])C(=O)NCc4ccccn4
Chemical ID:
5991624
Name [?]:
5-(2,4-dimethoxyphenyl)-2-(4-nitrophenyl)-N-(2-pyridylmethyl)pyrazole-3-carboxamide
SMILES [?]:
COc1ccc(c(c1)OC)c2cc(n(n2)c3ccc(cc3)[N+](=O)[O-])C(=O)NCc4ccccn4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H21N5O5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:6.17118
Area:706.815
Solvation:-11.4992
Coulombic:-57.2328
Bond Count [?]
All:37
Single:24
Double:13
Rotors:9
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:459.454
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:3.58
LogP (Chemaxon):2.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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