Chemical ID: 4703752

Cc1c(nc(s1)c2cnccn2)O
Chemical ID:
4703752
Name [?]:
5-methyl-2-pyrazin-2-yl-thiazol-4-ol
SMILES [?]:
Cc1c(nc(s1)c2cnccn2)O
InChi [?]:
InChI=1/C8H7N3OS/c1-5-7(12)11-8(13-5)6-4-9-2-3-10-6/h2-4,12H,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,8,2,7,3,5,9,12,4,13,6/rA:13nCCCNCSCCNCCNO/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s9;d10;d7s11;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H7N3OS
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.4365
Area:355.774
Solvation:-2.45784
Coulombic:-31.9122
Bond Count [?]
All:14
Single:9
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:193.227
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:0.13
LogP (Chemaxon):0.88

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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