Chemical ID: 6433139

Cc1cc(c(cc1Br)C(C)C)OCC(=O)NN=Cc2ccccc2OC(=O)C
Chemical ID:
6433139
Name [?]:
[2-[[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]aminoiminomethyl]phenyl] acetate
SMILES [?]:
Cc1cc(c(cc1Br)C(C)C)OCC(=O)NN=Cc2ccccc2OC(=O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H23BrN2O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.262
Area:645.274
Solvation:-5.86981
Coulombic:-44.1141
Bond Count [?]
All:29
Single:20
Double:9
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:447.322
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.68
LogP (Chemaxon):4.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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