Chemical ID: 4646728

c1cc2c(cc1NC(=O)c3ccc(o3)Br)OCCO2
Chemical ID:
4646728
Name [?]:
5-bromo-N-(2,5-dioxabicyclo[4.4.0]deca-6,8,10-trien-8-yl)furan-2-carboxamide
SMILES [?]:
c1cc2c(cc1NC(=O)c3ccc(o3)Br)OCCO2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H10BrNO4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.81692
Area:448.037
Solvation:-3.38401
Coulombic:-46.5228
Bond Count [?]
All:21
Single:15
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:324.127
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.12
LogP (Chemaxon):1.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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