4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol

C84H66Cl6N24O7S5 — CID 160932091

IUPAC4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol
SMILESCc1nc(C)c(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1ncc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1nsc(C)c1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1sncc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnoc2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnsc2)n1
InChIInChI=1S/2C15H13ClN4OS.2C14H11ClN4OS.C13H9ClN4O2.C13H9ClN4OS/c1-7-15(22-8(2)19-7)14-13(18-6-12(17)20-14)9-3-4-11(21)10(16)5-9;1-7-13(8(2)22-20-7)15-14(18-6-12(17)19-15)9-3-4-11(21)10(16)5-9;1-7-9(5-18-21-7)14-13(17-6-12(16)19-14)8-2-3-11(20)10(15)4-8;1-7-17-5-11(21-7)14-13(18-6-12(16)19-14)8-2-3-10(20)9(15)4-8;2*14-9-3-7(1-2-10(9)19)12-13(8-4-17-20-6-8)18-11(15)5-16-12/h3-6,21H,1-2H3,(H2,17,20);3-6,21H,1-2H3,(H2,17,19);2*2-6,20H,1H3,(H2,16,19);2*1-6,19H,(H2,15,18)
InChIKeySTJYOMOUVPMTSK-UHFFFAOYSA-N
MW1896.67 g/mol
LogP20.63
Rot. Bonds12

About 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol

4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol (PubChem CID 160932091) has the molecular formula C84H66Cl6N24O7S5 and a molecular weight of 1896.67 g/mol. Its IUPAC name is 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol.

Molecular Properties

Compound Name4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol
PubChem CID160932091
Molecular FormulaC84H66Cl6N24O7S5
Molecular Weight1896.67 g/mol
Exact Mass1892.23
IUPAC Name4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol
SMILESCc1nc(C)c(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1ncc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1nsc(C)c1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1sncc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnoc2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnsc2)n1
InChIInChI=1S/2C15H13ClN4OS.2C14H11ClN4OS.C13H9ClN4O2.C13H9ClN4OS/c1-7-15(22-8(2)19-7)14-13(18-6-12(17)20-14)9-3-4-11(21)10(16)5-9;1-7-13(8(2)22-20-7)15-14(18-6-12(17)19-15)9-3-4-11(21)10(16)5-9;1-7-9(5-18-21-7)14-13(17-6-12(16)19-14)8-2-3-11(20)10(15)4-8;1-7-17-5-11(21-7)14-13(18-6-12(16)19-14)8-2-3-10(20)9(15)4-8;2*14-9-3-7(1-2-10(9)19)12-13(8-4-17-20-6-8)18-11(15)5-16-12/h3-6,21H,1-2H3,(H2,17,20);3-6,21H,1-2H3,(H2,17,19);2*2-6,20H,1H3,(H2,16,19);2*1-6,19H,(H2,15,18)
InChIKeySTJYOMOUVPMTSK-UHFFFAOYSA-N
XLogP20.63
TPSA522.66 Ų
H-Bond Donors12
H-Bond Acceptors36
Rotatable Bonds12
Heavy Atoms126
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001896.67
LogP ≤ 520.63
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1036

Analyze 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol?
The IUPAC name of 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol (CID 160932091) is 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol.
What is the SMILES notation for 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol?
The canonical SMILES for 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol is Cc1nc(C)c(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1ncc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)s1.Cc1nsc(C)c1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1sncc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnoc2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cnsc2)n1.
What is the InChIKey of 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol?
The InChIKey is STJYOMOUVPMTSK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H13ClN4OS.2C14H11ClN4OS.C13H9ClN4O2.C13H9ClN4OS/c1-7-15(22-8(2)19-7)14-13(18-6-12(17)20-14)9-3-4-11(21)10(16)5-9;1-7-13(8(2)22-20-7)15-14(18-6-12(17)19-15)9-3-4-11(21)10(16)5-9;1-7-9(5-18-21-7)14-13(17-6-12(16)19-14)8-2-3-11(20)10(15)4-8;1-7-17-5-11(21-7)14-13(18-6-12(16)19-14)8-2-3-10(20)9(15)4-8;2*14-9-3-7(1-2-10(9)19)12-13(8-4-17-20-6-8)18-11(15)5-16-12/h3-6,21H,1-2H3,(H2,17,20);3-6,21H,1-2H3,(H2,17,19);2*2-6,20H,1H3,(H2,16,19);2*1-6,19H,(H2,15,18).
What are the key properties of 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol?
4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol has a molecular weight of 1896.67 g/mol, XLogP of 20.63, 12 rotatable bonds, 12 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-amino-3-(2,4-dimethyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3,5-dimethyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-oxazol-4-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,2-thiazol-4-yl)pyrazin-2-yl]-2-chlorophenol is sourced from PubChem (CID 160932091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).