Chemical ID: 6799821

CCOC(=O)N1CCN(CC1)c2c(c(=O)c2=O)c3ccc(cc3)C
Chemical ID:
6799821
Name [?]:
ethyl 4-[3,4-dioxo-2-(p-tolyl)-1-cyclobutenyl]piperazine-1-carboxylate
SMILES [?]:
CCOC(=O)N1CCN(CC1)c2c(c(=O)c2=O)c3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H20N2O4
All Atoms:44
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.1074
Area:543.866
Solvation:-3.4892
Coulombic:-54.0233
Bond Count [?]
All:26
Single:19
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:328.362
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:2.36
LogP (Chemaxon):2.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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