N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine

C120H115N19O21S10 — CID 167542079

IUPACN-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine
SMILESCOc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(CCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1
InChIInChI=1S/C19H19N3O3S.C18H18N4O3S.C18H17NO3S2.C17H16N2O2S2.C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3;2-5,8-12H,6-7H2,1H3;3-7,9-10H,8H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;13-;;;;/m..1..../s1
InChIKeyBICFUGUHQFIZCM-YZGJWYBQSA-N
MW2480.02 g/mol
LogP21.82
Rot. Bonds38

About N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine

N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine (PubChem CID 167542079) has the molecular formula C120H115N19O21S10 and a molecular weight of 2480.02 g/mol. Its IUPAC name is N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine.

Molecular Properties

Compound NameN-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine
PubChem CID167542079
Molecular FormulaC120H115N19O21S10
Molecular Weight2480.02 g/mol
Exact Mass2477.57
IUPAC NameN-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine
SMILESCOc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(CCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1
InChIInChI=1S/C19H19N3O3S.C18H18N4O3S.C18H17NO3S2.C17H16N2O2S2.C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3;2-5,8-12H,6-7H2,1H3;3-7,9-10H,8H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;13-;;;;/m..1..../s1
InChIKeyBICFUGUHQFIZCM-YZGJWYBQSA-N
XLogP21.82
TPSA556.79 Ų
H-Bond Donors4
H-Bond Acceptors43
Rotatable Bonds38
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002480.02
LogP ≤ 521.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1043

Analyze N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine?
The IUPAC name of N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine (CID 167542079) is N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine.
What is the SMILES notation for N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine?
The canonical SMILES for N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine is COc1ncc(-c2ccc(S(C)(=O)=O)cc2)nc1NCc1ccccc1.COc1ncc(NCc2ccccn2)nc1-c1ccc(S(C)(=O)=O)cc1.COc1ncc(NCc2cnco2)nc1-c1ccc(S(C)(=O)=O)cc1.CS(=O)(=O)c1ccc(-c2cccc(NCc3ncco3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(CCc3cccs3)n2)cc1.CS(=O)(=O)c1ccc(-c2cncc(SCc3ccco3)n2)cc1.C[C@@H](Oc1cccc(-c2ccc(S(C)(=O)=O)cc2)n1)c1cccs1.
What is the InChIKey of N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine?
The InChIKey is BICFUGUHQFIZCM-YZGJWYBQSA-N. The full InChI is InChI=1S/C19H19N3O3S.C18H18N4O3S.C18H17NO3S2.C17H16N2O2S2.C16H16N4O4S.C16H15N3O3S.C16H14N2O3S2/c1-25-19-18(20-12-14-6-4-3-5-7-14)22-17(13-21-19)15-8-10-16(11-9-15)26(2,23)24;1-25-18-17(13-6-8-15(9-7-13)26(2,23)24)22-16(12-21-18)20-11-14-5-3-4-10-19-14;1-13(17-6-4-12-23-17)22-18-7-3-5-16(19-18)14-8-10-15(11-9-14)24(2,20)21;1-23(20,21)16-8-4-13(5-9-16)17-12-18-11-14(19-17)6-7-15-3-2-10-22-15;1-23-16-15(11-3-5-13(6-4-11)25(2,21)22)20-14(9-19-16)18-8-12-7-17-10-24-12;1-23(20,21)13-7-5-12(6-8-13)14-3-2-4-15(19-14)18-11-16-17-9-10-22-16;1-23(19,20)14-6-4-12(5-7-14)15-9-17-10-16(18-15)22-11-13-3-2-8-21-13/h3-11,13H,12H2,1-2H3,(H,20,22);3-10,12H,11H2,1-2H3,(H,20,22);3-13H,1-2H3;2-5,8-12H,6-7H2,1H3;3-7,9-10H,8H2,1-2H3,(H,18,20);2-10H,11H2,1H3,(H,18,19);2-10H,11H2,1H3/t;;13-;;;;/m..1..../s1.
What are the key properties of N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine?
N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine has a molecular weight of 2480.02 g/mol, XLogP of 21.82, 38 rotatable bonds, 4 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-methoxy-6-(4-methylsulfonylphenyl)pyrazin-2-amine;2-(furan-2-ylmethylsulfanyl)-6-(4-methylsulfonylphenyl)pyrazine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-5-ylmethyl)pyrazin-2-amine;5-methoxy-6-(4-methylsulfonylphenyl)-N-(pyridin-2-ylmethyl)pyrazin-2-amine;6-(4-methylsulfonylphenyl)-N-(1,3-oxazol-2-ylmethyl)pyridin-2-amine;2-(4-methylsulfonylphenyl)-6-[(1R)-1-thiophen-2-ylethoxy]pyridine;2-(4-methylsulfonylphenyl)-6-(2-thiophen-2-ylethyl)pyrazine is sourced from PubChem (CID 167542079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).