Chemical ID: 6423323

c1ccc2c(c1)Nc3cc(nnc3S2)Cl
Chemical ID:
6423323
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
InChi [?]:
InChI=1/C10H6ClN3S/c11-9-5-7-10(14-13-9)15-8-4-2-1-3-6(8)12-7/h1-5,12H
InChi Info:
AuxInfo=1/0/N:1,2,6,3,9,5,8,4,10,13,15,7,11,12,14/rA:15nCCCCCCNCCCNNCSCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s10;d11;d8s12;s4s13;s10;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6ClN3S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.1356
Area:379.501
Solvation:-1.35191
Coulombic:-17.5284
Bond Count [?]
All:17
Single:11
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:235.694
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.5
LogP (Chemaxon):2.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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