Chemical ID: 4346363

c1ccc(c(c1)C=C2C(=O)N=C(S2)Nc3ccc(cc3)Br)[N+](=O)[O-]
Chemical ID:
4346363
Name [?]:
2-(4-bromophenyl)amino-5-[(2-nitrophenyl)methylene]thiazol-4-one
SMILES [?]:
c1ccc(c(c1)C=C2C(=O)N=C(S2)Nc3ccc(cc3)Br)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H10BrN3O3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.34296
Area:535.151
Solvation:-6.03581
Coulombic:-43.163
Bond Count [?]
All:26
Single:16
Double:10
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:404.239
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.92
LogP (Chemaxon):4.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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