Chemical ID: 4152820

CCOc1ccc(cc1)C=CC(=O)Nc2nc(cs2)c3ccc(cc3)Br
Chemical ID:
4152820
Name [?]:
N-[4-(4-bromophenyl)thiazol-2-yl]-3-(4-ethoxyphenyl)-prop-2-enamide
SMILES [?]:
CCOc1ccc(cc1)C=CC(=O)Nc2nc(cs2)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H17BrN2O2S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.0733
Area:599.1
Solvation:-3.90422
Coulombic:-35.8738
Bond Count [?]
All:28
Single:18
Double:10
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:429.331
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.24
LogP (Chemaxon):5.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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