Chemical ID: 5585259

COc1ccc(cc1)Oc2c3ccsc3ncn2
Chemical ID:
5585259
Name [?]:
2-(4-methoxyphenoxy)-7-thia-3,5-diazabicyclo[4.3.0]nona-2,4,8,10-tetraene
SMILES [?]:
COc1ccc(cc1)Oc2c3ccsc3ncn2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H10N2O2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.72258
Area:426.639
Solvation:-2.94341
Coulombic:-27.4212
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:258.297
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.72
LogP (Chemaxon):3.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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