Chemical ID: 6427832

CCOC(=O)C(=CNc1ccc2c(c1)scn2)C(=O)OCC
Chemical ID:
6427832
Name [?]:
diethyl 2-(benzothiazol-6-ylaminomethylene)propanedioate
SMILES [?]:
CCOC(=O)C(=CNc1ccc2c(c1)scn2)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H16N2O4S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.0206
Area:524.945
Solvation:-3.10306
Coulombic:-54.6468
Bond Count [?]
All:23
Single:16
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:320.365
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.65
LogP (Chemaxon):2.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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