Chemical ID: 3999303

c1ccc2c(c1)OCC(O2)C(=O)N3CCNCC3
Chemical ID:
3999303
Name [?]:
2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-3-yl-piperazin-1-yl-methanone
SMILES [?]:
c1ccc2c(c1)OCC(O2)C(=O)N3CCNCC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H16N2O3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:6.61329
Area:412.361
Solvation:-3.69575
Coulombic:-42.3267
Bond Count [?]
All:20
Single:16
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:248.278
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:0.46
LogP (Chemaxon):0.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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