Chemical ID: 5494575

CCc1ccc(cc1)S(=O)(=O)N=c2n(c(cs2)c3ccc(cc3)Br)CC=C
Chemical ID:
5494575
Name [?]:
N-[3-allyl-4-(4-bromophenyl)-thiazol-2-ylidene]-4-ethyl-benzenesulfonamide
SMILES [?]:
CCc1ccc(cc1)S(=O)(=O)N=c2n(c(cs2)c3ccc(cc3)Br)CC=C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H19BrN2O2S2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:13.4008
Area:596.481
Solvation:-1.51126
Coulombic:-19.7482
Bond Count [?]
All:29
Single:18
Double:11
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:463.413
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.83
LogP (Chemaxon):6.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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