Chemical ID: 6619646

c1cnc(nc1c2nccs2)N
Chemical ID:
6619646
Name [?]:
4-thiazol-2-ylpyrimidin-2-amine
SMILES [?]:
c1cnc(nc1c2nccs2)N
InChi [?]:
InChI=1/C7H6N4S/c8-7-10-2-1-5(11-7)6-9-3-4-12-6/h1-4H,(H2,8,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,9,10,6,7,4,12,8,3,5,11/rA:12nCCNCNCCNCCSN/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;d9;s7s10;s4;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6N4S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.60268
Area:335.876
Solvation:-1.79421
Coulombic:-33.0979
Bond Count [?]
All:13
Single:8
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:178.215
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:-0.16
LogP (Chemaxon):0.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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