Chemical ID: 5987703

CCCCCNC(=O)c1cc(nn1c2cccc(c2)[N+](=O)[O-])c3ccc(c(c3)C)C
Chemical ID:
5987703
Name [?]:
5-(3,4-dimethylphenyl)-2-(3-nitrophenyl)-N-pentyl-pyrazole-3-carboxamide
SMILES [?]:
CCCCCNC(=O)c1cc(nn1c2cccc(c2)[N+](=O)[O-])c3ccc(c(c3)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H26N4O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:9.31074
Area:677.895
Solvation:-7.63663
Coulombic:-41.0161
Bond Count [?]
All:32
Single:22
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:406.478
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:6.0
LogP (Chemaxon):5.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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