Chemical ID: 5798386

c1ccc(c(c1)N=C2NC(=O)C(=Cc3ccc(cc3)OCc4ccc(cc4)[N+](=O)[O-])S2)Cl
Chemical ID:
5798386
Name [?]:
2-(2-chlorophenyl)imino-5-[[4-[(4-nitrophenyl)methoxy]phenyl]methylene]thiazolidin-4-one
SMILES [?]:
c1ccc(c(c1)N=C2NC(=O)C(=Cc3ccc(cc3)OCc4ccc(cc4)[N+](=O)[O-])S2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H16ClN3O4S
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:8.64202
Area:699.922
Solvation:-8.85603
Coulombic:-50.2678
Bond Count [?]
All:35
Single:22
Double:13
Rotors:6
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:465.91
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:5.11
LogP (Chemaxon):6.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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