Chemical ID: 6646631

CC(C(=O)NN=Cc1ccc(cc1)OC(=O)c2ccc(cc2)OC)Oc3ccc(cc3)Br
Chemical ID:
6646631
Name [?]:
[4-[2-(4-bromophenoxy)propanoylaminoiminomethyl]phenyl] 4-methoxybenzoate
SMILES [?]:
CC(C(=O)NN=Cc1ccc(cc1)OC(=O)c2ccc(cc2)OC)Oc3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H21BrN2O5
All Atoms:32
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.7027
Area:711.391
Solvation:-7.08212
Coulombic:-54.1165
Bond Count [?]
All:34
Single:22
Double:12
Rotors:10
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:497.338
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:6.42
LogP (Chemaxon):5.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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