Chemical ID: 6422746

c1cc(sc1)c2cncnc2
Chemical ID:
6422746
Name [?]:
5-(2-thienyl)pyrimidine
SMILES [?]:
c1cc(sc1)c2cncnc2
InChi [?]:
InChI=1/C8H6N2S/c1-2-8(11-3-1)7-4-9-6-10-5-7/h1-6H
InChi Info:
AuxInfo=1/0/N:1,2,5,7,11,9,6,3,8,10,4/E:(4,5)(9,10)/rA:11nCCCSCCCNCNC/rB:s1;d2;s3;d1s4;s3;s6;d7;s8;d9;d6s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H6N2S
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.36338
Area:316.827
Solvation:-1.5573
Coulombic:-10.6209
Bond Count [?]
All:12
Single:7
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:162.213
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:0.69
LogP (Chemaxon):1.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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