Chemical ID: 7579353

Cc1c2ccccc2nc-3c1CSc4c3cccc4F
Chemical ID:
7579353
Name [?]:
None
SMILES [?]:
Cc1c2ccccc2nc-3c1CSc4c3cccc4F
InChi [?]:
InChI=1/C17H12FNS/c1-10-11-5-2-3-8-15(11)19-16-12-6-4-7-14(18)17(12)20-9-13(10)16/h2-8H,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,5,6,17,4,16,18,7,12,2,3,15,11,19,8,10,14,20,9,13/rA:20nCCCCCCCCNCCCSCCCCCCF/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;d2s10;s11;s12;s13;s10s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H12FNS
All Atoms:32
Heavy Atoms:20
Chiral Atoms:None
ZAP Information [?]
Total:8.4873
Area:425.527
Solvation:-2.15088
Coulombic:-12.003
Bond Count [?]
All:23
Single:15
Double:8
Rotors:0
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.92
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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