Chemical ID: 4455484

Cc1cccc(c1)NCc2cc(c(c(c2)Br)OCc3ccccc3)OC
Chemical ID:
4455484
Name [?]:
N-[(4-benzyloxy-3-bromo-5-methoxy-phenyl)methyl]-3-methyl-aniline
SMILES [?]:
Cc1cccc(c1)NCc2cc(c(c(c2)Br)OCc3ccccc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H22BrNO2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.685
Area:598.662
Solvation:-4.28152
Coulombic:-30.0565
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:412.32
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.88
LogP (Chemaxon):5.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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