Chemical ID: 4927715

CCOC(=O)CNC1=c2ccccc2=S(=O)(N=N1)O
Chemical ID:
4927715
Name [?]:
ethyl 2-[(7-hydroxy-7-oxo-7$l^{6}-thia-8,9-diazabicyclo[4.4.0]deca-2,4,6,8,10-pentaen-10-yl)amino]acetate
SMILES [?]:
CCOC(=O)CNC1=c2ccccc2=S(=O)(N=N1)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H13N3O4S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:8.55112
Area:458.681
Solvation:-2.9159
Coulombic:-53.6603
Bond Count [?]
All:20
Single:13
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:283.305
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:1.92
LogP (Chemaxon):0.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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