Chemical ID: 4916356

CSc1c2c3c(c(nnn3)Cl)sc2ns1
Chemical ID:
4916356
Name [?]:
None
SMILES [?]:
CSc1c2c3c(c(nnn3)Cl)sc2ns1
InChi [?]:
InChI=1/C7H3ClN4S3/c1-13-7-2-3-4(5(8)10-12-9-3)14-6(2)11-15-7/h1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,6,7,13,3,11,10,8,14,9,2,12,15/rA:15nCSCCCCCNNNClSCNS/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;s7;s6;s4s12;d13;s3s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H3ClN4S3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.77058
Area:405.868
Solvation:-1.37611
Coulombic:-7.39112
Bond Count [?]
All:17
Single:12
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:274.776
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.2
LogP (Chemaxon):2.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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