Chemical ID: 4300784

CCCOC(=O)C1=C(NC(=O)NC1c2ccc(c(c2)[N+](=O)[O-])O)C
Chemical ID:
4300784
Name [?]:
propyl 4-(4-hydroxy-3-nitro-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
SMILES [?]:
CCCOC(=O)C1=C(NC(=O)NC1c2ccc(c(c2)[N+](=O)[O-])O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H17N3O6
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:3.19124
Area:493.734
Solvation:-9.15211
Coulombic:-80.6488
Bond Count [?]
All:25
Single:18
Double:7
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:335.312
H-Bond Donors:3
H-Bond Acceptors:9
XLogP:1.7
LogP (Chemaxon):0.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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