Chemical ID: 7087226

c1cc2c(c(c1)S(=O)(=O)N)non2
Chemical ID:
7087226
Name [?]:
8-oxa-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraene-5-sulfonamide
SMILES [?]:
c1cc2c(c(c1)S(=O)(=O)N)non2
InChi [?]:
InChI=1/C6H5N3O3S/c7-13(10,11)5-3-1-2-4-6(5)9-12-8-4/h1-3H,(H2,7,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,10,13,11,8,9,12,7/E:(10,11)/CRV:13.6/rA:13nCCCCCCSOONNON/rB:d1;s2;s3;s4;s1d5;s5;d7;d7;s7;d4;s11;d3s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5N3O3S
All Atoms:18
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.31812
Area:325.779
Solvation:-2.82635
Coulombic:-17.4147
Bond Count [?]
All:14
Single:8
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:199.188
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.24
LogP (Chemaxon):0.31

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