Chemical ID: 4926473

Cn1c(cc(c1c2ccsc2)c3ccsc3)c4cccs4
Chemical ID:
4926473
Name [?]:
1-methyl-5-(2-thienyl)-2,3-bis(3-thienyl)pyrrole
SMILES [?]:
Cn1c(cc(c1c2ccsc2)c3ccsc3)c4cccs4
InChi [?]:
InChI=1/C17H13NS3/c1-18-15(16-3-2-6-21-16)9-14(12-4-7-19-10-12)17(18)13-5-8-20-11-13/h2-11H,1H3
InChi Info:
AuxInfo=1/0/N:1,19,18,13,8,20,14,9,4,16,11,12,7,5,3,17,6,2,15,10,21/rA:21nCNCCCCCCCSCCCCSCCCCCS/rB:s1;s2;d3;s4;s2d5;s6;s7;d8;s9;d7s10;s5;s12;d13;s14;d12s15;s3;d17;s18;d19;s17s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H13NS3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.768
Area:499.429
Solvation:-1.71768
Coulombic:-9.75561
Bond Count [?]
All:24
Single:16
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.49
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:4.62
LogP (Chemaxon):4.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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