Chemical ID: 6473664

c1csc2c1C(=O)CCC23CCCCC3
Chemical ID:
6473664
Name [?]:
None
SMILES [?]:
c1csc2c1C(=O)CCC23CCCCC3
InChi [?]:
InChI=1/C13H16OS/c14-11-4-8-13(6-2-1-3-7-13)12-10(11)5-9-15-12/h5,9H,1-4,6-8H2
InChi Info:
AuxInfo=1/0/N:13,12,14,8,1,11,15,9,2,5,6,4,10,7,3/E:(2,3)(6,7)/rA:15nCCSCCCOCCCCCCCC/rB:d1;s2;s3;s1d4;s5;d6;s6;s8;s4s9;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16OS
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.70185
Area:368.409
Solvation:-1.50838
Coulombic:-9.5601
Bond Count [?]
All:17
Single:14
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:220.332
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.74
LogP (Chemaxon):2.81

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Descriptor Annotations

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