Chemical ID: 4867502

c1ccc(cc1)C2=CC(c3c(=O)[nH]c(=S)[nH]c3O2)O
Chemical ID:
4867502
Name [?]:
10-hydroxy-8-phenyl-4-thioxo-7-oxa-3,5-diazabicyclo[4.4.0]deca-8,11-dien-2-one
SMILES [?]:
c1ccc(cc1)C2=CC(c3c(=O)[nH]c(=S)[nH]c3O2)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H10N2O3S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:7.58708
Area:440.6
Solvation:-3.42793
Coulombic:-58.0115
Bond Count [?]
All:21
Single:14
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:274.296
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.58
LogP (Chemaxon):0.91

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue