Chemical ID: 4162420

CC(C)c1ccc(cc1)NC(=O)C=Cc2cc(c(c(c2)Br)OCc3ccccc3)OC
Chemical ID:
4162420
Name [?]:
3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-N-(4-isopropylphenyl)-prop-2-enamide
SMILES [?]:
CC(C)c1ccc(cc1)NC(=O)C=Cc2cc(c(c(c2)Br)OCc3ccccc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H26BrNO3
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:11.8567
Area:679.569
Solvation:-5.13251
Coulombic:-39.4074
Bond Count [?]
All:33
Single:22
Double:11
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:480.394
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:6.74
LogP (Chemaxon):6.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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