Chemical ID: 3994584

C1CCc2c(c3c(=S)[nH]c(=S)[nH]c3s2)C1
Chemical ID:
3994584
Name [?]:
None
SMILES [?]:
C1CCc2c(c3c(=S)[nH]c(=S)[nH]c3s2)C1
InChi [?]:
InChI=1/C10H10N2S3/c13-8-7-5-3-1-2-4-6(5)15-9(7)12-10(14)11-8/h1-4H2,(H2,11,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,15,3,5,4,6,7,13,10,9,12,8,11,14/rA:15nCCCCCCCSNCSNCSC/rB:s1;s2;s3;d4;s5;s6;d7;s7;s9;d10;s10;d6s12;s4s13;s1s5;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10N2S3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:9.26876
Area:393.696
Solvation:-0.573642
Coulombic:-25.3389
Bond Count [?]
All:17
Single:13
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:254.398
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.98
LogP (Chemaxon):3.29

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Descriptor Annotations

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