Chemical ID: 4352367

Cc1cc(c(n1c2cccc(c2)[N+](=O)[O-])C)C=C3C(=O)NC(=O)N(C3=O)c4ccc5c(c4)OCO5
Chemical ID:
4352367
Name [?]:
1-benzo[1,3]dioxol-5-yl-5-[[2,5-dimethyl-1-(3-nitrophenyl)-pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione
SMILES [?]:
Cc1cc(c(n1c2cccc(c2)[N+](=O)[O-])C)C=C3C(=O)NC(=O)N(C3=O)c4ccc5c(c4)OCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H18N4O7
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:6.49423
Area:677.845
Solvation:-10.4519
Coulombic:-78.8826
Bond Count [?]
All:39
Single:26
Double:13
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:474.422
H-Bond Donors:1
H-Bond Acceptors:10
XLogP:2.98
LogP (Chemaxon):2.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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