Chemical ID: 6448566

c1csc2c1C(=O)c3c(ccs3)C2=O
Chemical ID:
6448566
Name [?]:
None
SMILES [?]:
c1csc2c1C(=O)c3c(ccs3)C2=O
InChi [?]:
InChI=1/C10H4O2S2/c11-7-5-1-3-13-9(5)8(12)6-2-4-14-10(6)7/h1-4H
InChi Info:
AuxInfo=1/0/N:1,10,2,11,5,9,6,13,4,8,7,14,3,12/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:14nCCSCCCOCCCCSCO/rB:d1;s2;s3;s1d4;s5;d6;s6;d8;s9;d10;s8s11;s4s9;d13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H4O2S2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.42682
Area:358.065
Solvation:-2.52481
Coulombic:-16.7919
Bond Count [?]
All:16
Single:10
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:220.27
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.99
LogP (Chemaxon):1.27

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