Chemical ID: 6277583

COC(=O)Cn1c2ccccc2sc1=NC(=O)c3cc(nc4c3cccc4)c5cccs5
Chemical ID:
6277583
Name [?]:
methyl 2-[2-[[2-(2-thienyl)-4-quinolyl]carbonylimino]benzothiazol-3-yl]acetate
SMILES [?]:
COC(=O)Cn1c2ccccc2sc1=NC(=O)c3cc(nc4c3cccc4)c5cccs5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H17N3O3S2
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:12.1285
Area:631.428
Solvation:-3.65718
Coulombic:-50.1582
Bond Count [?]
All:36
Single:23
Double:13
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:459.542
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.71
LogP (Chemaxon):5.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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