Chemical ID: 4334999

CN1C(=O)C(=Cc2cc(cc(c2O)OC)[N+](=O)[O-])C(=O)N(C1=O)C
Chemical ID:
4334999
Name [?]:
5-[(2-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione
SMILES [?]:
CN1C(=O)C(=Cc2cc(cc(c2O)OC)[N+](=O)[O-])C(=O)N(C1=O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H13N3O7
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:2.72758
Area:498.976
Solvation:-9.74681
Coulombic:-76.8501
Bond Count [?]
All:25
Single:17
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:335.269
H-Bond Donors:1
H-Bond Acceptors:10
XLogP:0.25
LogP (Chemaxon):0.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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