4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol

C89H71Cl6N21O7S4 — CID 161033252

IUPAC4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol
SMILESCc1cc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)sc1C.Cc1ccsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1C.Cc1ncsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cccs2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cncnc2)n1
InChIInChI=1S/C16H14ClN3O2.C16H14ClN3OS.C15H12ClN3OS.C14H10ClN5O.C14H11ClN4OS.C14H10ClN3OS/c1-8-7-22-16(9(8)2)15-14(19-6-13(18)20-15)10-3-4-12(21)11(17)5-10;1-8-5-13(22-9(8)2)16-15(19-7-14(18)20-16)10-3-4-12(21)11(17)6-10;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9;15-10-3-8(1-2-11(10)21)13-14(20-12(16)6-19-13)9-4-17-7-18-5-9;1-7-14(21-6-18-7)13-12(17-5-11(16)19-13)8-2-3-10(20)9(15)4-8;15-9-6-8(3-4-10(9)19)13-14(11-2-1-5-20-11)18-12(16)7-17-13/h2*3-7,21H,1-2H3,(H2,18,20);2-7,20H,1H3,(H2,17,19);1-7,21H,(H2,16,20);2-6,20H,1H3,(H2,16,19);1-7,19H,(H2,16,18)
InChIKeyTZXFQUHGACNXFS-UHFFFAOYSA-N
MW1887.67 g/mol
LogP22.39
Rot. Bonds12

About 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol

4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol (PubChem CID 161033252) has the molecular formula C89H71Cl6N21O7S4 and a molecular weight of 1887.67 g/mol. Its IUPAC name is 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol.

Molecular Properties

Compound Name4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol
PubChem CID161033252
Molecular FormulaC89H71Cl6N21O7S4
Molecular Weight1887.67 g/mol
Exact Mass1883.29
IUPAC Name4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol
SMILESCc1cc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)sc1C.Cc1ccsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1C.Cc1ncsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cccs2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cncnc2)n1
InChIInChI=1S/C16H14ClN3O2.C16H14ClN3OS.C15H12ClN3OS.C14H10ClN5O.C14H11ClN4OS.C14H10ClN3OS/c1-8-7-22-16(9(8)2)15-14(19-6-13(18)20-15)10-3-4-12(21)11(17)5-10;1-8-5-13(22-9(8)2)16-15(19-7-14(18)20-16)10-3-4-12(21)11(17)6-10;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9;15-10-3-8(1-2-11(10)21)13-14(20-12(16)6-19-13)9-4-17-7-18-5-9;1-7-14(21-6-18-7)13-12(17-5-11(16)19-13)8-2-3-10(20)9(15)4-8;15-9-6-8(3-4-10(9)19)13-14(11-2-1-5-20-11)18-12(16)7-17-13/h2*3-7,21H,1-2H3,(H2,18,20);2-7,20H,1H3,(H2,17,19);1-7,21H,(H2,16,20);2-6,20H,1H3,(H2,16,19);1-7,19H,(H2,16,18)
InChIKeyTZXFQUHGACNXFS-UHFFFAOYSA-N
XLogP22.39
TPSA483.99 Ų
H-Bond Donors12
H-Bond Acceptors32
Rotatable Bonds12
Heavy Atoms127
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001887.67
LogP ≤ 522.39
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1032

Analyze 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol with MolForge

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Launch Full Analysis

Related Compounds

2-Chlorofuro[2,3-b]pyrazine;5-chlorofuro[3,2-b]pyridine;5-chlorofuro[2,3-c]pyridine;2-chloro-4-phenylfuro[3,2-d]pyrimidine;2-chloro-4-(3-phenylphenyl)furo[3,2-d]pyrimidine;2-chloro-4-(4-phenylphenyl)furo[3,2-d]pyrimidine;3-chlorothieno[2,3-b]pyrazine
CID 157392115
[4-Amino-2-[5-(1-fluoroethyl)furan-2-yl]thieno[2,3-d]pyrimidin-6-yl]-phenylmethanol;[4-amino-2-(2-methyl-4-pyridinyl)thieno[2,3-d]pyrimidin-6-yl]-(2-methoxyphenyl)methanol;[4-amino-2-(2-methyl-4-pyridinyl)thieno[2,3-d]pyrimidin-6-yl]-phenylmethanol;6-[(2-chlorophenyl)methyl]-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine;6-[(2-chlorophenyl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine;6-[(2-chlorophenyl)methyl]-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine;6-[(2-methoxyphenyl)methyl]-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 160170503
4-[5-amino-3-(4,5-dimethyl-1,3-thiazol-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1-methyl-1,2,4-triazol-3-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methyl-1H-1,2,4-triazol-3-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1,3,4-thiadiazol-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(1H-1,2,4-triazol-5-yl)pyrazin-2-yl]-2-chlorophenol
CID 160862307
4-[5-Amino-3-(3,5-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(5-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-chloro-6-[5-(cyclopropylmethylamino)-3-phenylpyrazin-2-yl]pyridin-3-ol;4-chloro-6-[5-(oxiran-2-ylmethylamino)-3-phenylpyrazin-2-yl]pyridin-3-ol
CID 161574048

Frequently Asked Questions

What is the IUPAC name of 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol?
The IUPAC name of 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol (CID 161033252) is 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol.
What is the SMILES notation for 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol?
The canonical SMILES for 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol is Cc1cc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)sc1C.Cc1ccsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1C.Cc1ncsc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cccs2)n1.Nc1cnc(-c2ccc(O)c(Cl)c2)c(-c2cncnc2)n1.
What is the InChIKey of 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol?
The InChIKey is TZXFQUHGACNXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2.C16H14ClN3OS.C15H12ClN3OS.C14H10ClN5O.C14H11ClN4OS.C14H10ClN3OS/c1-8-7-22-16(9(8)2)15-14(19-6-13(18)20-15)10-3-4-12(21)11(17)5-10;1-8-5-13(22-9(8)2)16-15(19-7-14(18)20-16)10-3-4-12(21)11(17)6-10;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9;15-10-3-8(1-2-11(10)21)13-14(20-12(16)6-19-13)9-4-17-7-18-5-9;1-7-14(21-6-18-7)13-12(17-5-11(16)19-13)8-2-3-10(20)9(15)4-8;15-9-6-8(3-4-10(9)19)13-14(11-2-1-5-20-11)18-12(16)7-17-13/h2*3-7,21H,1-2H3,(H2,18,20);2-7,20H,1H3,(H2,17,19);1-7,21H,(H2,16,20);2-6,20H,1H3,(H2,16,19);1-7,19H,(H2,16,18).
What are the key properties of 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol?
4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol has a molecular weight of 1887.67 g/mol, XLogP of 22.39, 12 rotatable bonds, 12 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-amino-3-(3,4-dimethylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4,5-dimethylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methyl-1,3-thiazol-5-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(3-methylthiophen-2-yl)pyrazin-2-yl]-2-chlorophenol;4-(5-amino-3-pyrimidin-5-ylpyrazin-2-yl)-2-chlorophenol;4-(5-amino-3-thiophen-2-ylpyrazin-2-yl)-2-chlorophenol is sourced from PubChem (CID 161033252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).