Chemical ID: 5709803

CCc1ccc(cc1)c2csc(n2)NC(=O)c3ccc(c(c3)[N+](=O)[O-])Cl
Chemical ID:
5709803
Name [?]:
4-chloro-N-[4-(4-ethylphenyl)thiazol-2-yl]-3-nitro-benzamide
SMILES [?]:
CCc1ccc(cc1)c2csc(n2)NC(=O)c3ccc(c(c3)[N+](=O)[O-])Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H14ClN3O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:6.46081
Area:596.843
Solvation:-8.46027
Coulombic:-38.4376
Bond Count [?]
All:28
Single:18
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:387.841
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.12
LogP (Chemaxon):5.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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