Chemical ID: 4221588

c1ccc(c(c1)N=C2NC(=O)C(=Cc3cc(ccc3Cl)[N+](=O)[O-])S2)Cl
Chemical ID:
4221588
Name [?]:
5-[(2-chloro-5-nitro-phenyl)methylene]-2-(2-chlorophenyl)imino-thiazolidin-4-one
SMILES [?]:
c1ccc(c(c1)N=C2NC(=O)C(=Cc3cc(ccc3Cl)[N+](=O)[O-])S2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H9Cl2N3O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:7.0488
Area:571.556
Solvation:-7.2401
Coulombic:-41.3334
Bond Count [?]
All:27
Single:17
Double:10
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:394.232
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.11
LogP (Chemaxon):5.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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