Chemical ID: 7669809

CC(=O)c1csc(n1)c2ccno2
Chemical ID:
7669809
Name [?]:
None
SMILES [?]:
CC(=O)c1csc(n1)c2ccno2
InChi [?]:
InChI=1/C8H6N2O2S/c1-5(11)6-4-13-8(10-6)7-2-3-9-12-7/h2-4H,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,5,2,4,9,7,12,8,3,13,6/rA:13nCCOCCSCNCCCNO/rB:s1;d2;s2;d4;s5;s6;s4d7;s7;d9;s10;d11;s9s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H6N2O2S
All Atoms:19
Heavy Atoms:13
Chiral Atoms:None
ZAP Information [?]
Total:5.95742
Area:358.093
Solvation:-2.99491
Coulombic:-16.6513
Bond Count [?]
All:14
Single:9
Double:5
Rotors:2
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.03
LogP (Chemaxon):None

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