Chemical ID: 4662392

c1cc2c(nc1)sc(=O)o2
Chemical ID:
4662392
Name [?]:
9-oxa-7-thia-5-azabicyclo[4.3.0]nona-1,3,5-trien-8-one
SMILES [?]:
c1cc2c(nc1)sc(=O)o2
InChi [?]:
InChI=1/C6H3NO2S/c8-6-9-4-2-1-3-7-5(4)10-6/h1-3H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,4,8,5,9,10,7/rA:10nCCCCNCSCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s3s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H3NO2S
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.58907
Area:287.387
Solvation:-1.5956
Coulombic:-25.9626
Bond Count [?]
All:11
Single:7
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:153.16
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.59
LogP (Chemaxon):1.97

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