Chemical ID: 6427901

c1ccc2c(c1)Cc3ccccc3SC2
Chemical ID:
6427901
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)Cc3ccccc3SC2
InChi [?]:
InChI=1/C14H12S/c1-2-7-13-10-15-14-8-4-3-6-12(14)9-11(13)5-1/h1-8H,9-10H2
InChi Info:
AuxInfo=1/0/N:1,2,10,11,6,9,3,12,7,15,5,8,4,13,14/rA:15nCCCCCCCCCCCCCSC/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s10;d11;d8s12;s13;s4s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.20123
Area:367.131
Solvation:-0.977042
Coulombic:-3.9344
Bond Count [?]
All:17
Single:11
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:212.311
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.94
LogP (Chemaxon):4.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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