3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine

C160H152F42N36O18 — CID 162211054

IUPAC3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCCOC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3C)cn12.CCOCc1ccc(-c2cn3c(C(F)(F)OCC)nnc3cn2)cc1.COC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12
InChIInChI=1S/2C19H19F5N4O2.3C18H17F5N4O2.3C17H15F5N4O2.C17H18F2N4O2/c2*1-4-30-19(23,24)17-27-26-16-8-25-15(9-28(16)17)14-6-5-13(7-11(14)2)12(3)29-10-18(20,21)22;2*1-3-29-18(22,23)16-26-25-15-8-24-14(9-27(15)16)13-6-4-12(5-7-13)11(2)28-10-17(19,20)21;1-3-29-18(22,23)16-26-25-15-7-24-14(8-27(15)16)13-5-4-12(6-11(13)2)9-28-10-17(19,20)21;2*1-10(28-9-16(18,19)20)11-3-5-12(6-4-11)13-8-26-14(7-23-13)24-25-15(26)17(21,22)27-2;1-10-5-11(8-28-9-16(18,19)20)3-4-12(10)13-7-26-14(6-23-13)24-25-15(26)17(21,22)27-2;1-3-24-11-12-5-7-13(8-6-12)14-10-23-15(9-20-14)21-22-16(23)17(18,19)25-4-2/h2*5-9,12H,4,10H2,1-3H3;2*4-9,11H,3,10H2,1-2H3;4-8H,3,9-10H2,1-2H3;2*3-8,10H,9H2,1-2H3;3-7H,8-9H2,1-2H3;5-10H,3-4,11H2,1-2H3/t2*12-;2*11-;;2*10-;;/m1010.10../s1
InChIKeyZSVSUUYTWISWCS-MHVDLJHJSA-N
MW3665.13 g/mol
LogP38.49
Rot. Bonds60

About 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine

3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 162211054) has the molecular formula C160H152F42N36O18 and a molecular weight of 3665.13 g/mol. Its IUPAC name is 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID162211054
Molecular FormulaC160H152F42N36O18
Molecular Weight3665.13 g/mol
Exact Mass3663.14
IUPAC Name3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCCOC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3C)cn12.CCOCc1ccc(-c2cn3c(C(F)(F)OCC)nnc3cn2)cc1.COC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12
InChIInChI=1S/2C19H19F5N4O2.3C18H17F5N4O2.3C17H15F5N4O2.C17H18F2N4O2/c2*1-4-30-19(23,24)17-27-26-16-8-25-15(9-28(16)17)14-6-5-13(7-11(14)2)12(3)29-10-18(20,21)22;2*1-3-29-18(22,23)16-26-25-15-8-24-14(9-27(15)16)13-6-4-12(5-7-13)11(2)28-10-17(19,20)21;1-3-29-18(22,23)16-26-25-15-7-24-14(8-27(15)16)13-5-4-12(6-11(13)2)9-28-10-17(19,20)21;2*1-10(28-9-16(18,19)20)11-3-5-12(6-4-11)13-8-26-14(7-23-13)24-25-15(26)17(21,22)27-2;1-10-5-11(8-28-9-16(18,19)20)3-4-12(10)13-7-26-14(6-23-13)24-25-15(26)17(21,22)27-2;1-3-24-11-12-5-7-13(8-6-12)14-10-23-15(9-20-14)21-22-16(23)17(18,19)25-4-2/h2*5-9,12H,4,10H2,1-3H3;2*4-9,11H,3,10H2,1-2H3;4-8H,3,9-10H2,1-2H3;2*3-8,10H,9H2,1-2H3;3-7H,8-9H2,1-2H3;5-10H,3-4,11H2,1-2H3/t2*12-;2*11-;;2*10-;;/m1010.10../s1
InChIKeyZSVSUUYTWISWCS-MHVDLJHJSA-N
XLogP38.49
TPSA553.86 Ų
H-Bond Donors
H-Bond Acceptors54
Rotatable Bonds60
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003665.13
LogP ≤ 538.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1054

Analyze 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine (CID 162211054) is 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine is CCOC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3C)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12.CCOC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3C)cn12.CCOCc1ccc(-c2cn3c(C(F)(F)OCC)nnc3cn2)cc1.COC(F)(F)c1nnc2cnc(-c3ccc(COCC(F)(F)F)cc3C)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@@H](C)OCC(F)(F)F)cc3)cn12.COC(F)(F)c1nnc2cnc(-c3ccc([C@H](C)OCC(F)(F)F)cc3)cn12.
What is the InChIKey of 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is ZSVSUUYTWISWCS-MHVDLJHJSA-N. The full InChI is InChI=1S/2C19H19F5N4O2.3C18H17F5N4O2.3C17H15F5N4O2.C17H18F2N4O2/c2*1-4-30-19(23,24)17-27-26-16-8-25-15(9-28(16)17)14-6-5-13(7-11(14)2)12(3)29-10-18(20,21)22;2*1-3-29-18(22,23)16-26-25-15-8-24-14(9-27(15)16)13-6-4-12(5-7-13)11(2)28-10-17(19,20)21;1-3-29-18(22,23)16-26-25-15-7-24-14(8-27(15)16)13-5-4-12(6-11(13)2)9-28-10-17(19,20)21;2*1-10(28-9-16(18,19)20)11-3-5-12(6-4-11)13-8-26-14(7-23-13)24-25-15(26)17(21,22)27-2;1-10-5-11(8-28-9-16(18,19)20)3-4-12(10)13-7-26-14(6-23-13)24-25-15(26)17(21,22)27-2;1-3-24-11-12-5-7-13(8-6-12)14-10-23-15(9-20-14)21-22-16(23)17(18,19)25-4-2/h2*5-9,12H,4,10H2,1-3H3;2*4-9,11H,3,10H2,1-2H3;4-8H,3,9-10H2,1-2H3;2*3-8,10H,9H2,1-2H3;3-7H,8-9H2,1-2H3;5-10H,3-4,11H2,1-2H3/t2*12-;2*11-;;2*10-;;/m1010.10../s1.
What are the key properties of 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine?
3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 3665.13 g/mol, XLogP of 38.49, 60 rotatable bonds, 0 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-(ethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[2-methyl-4-(2,2,2-trifluoroethoxymethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1S)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[ethoxy(difluoro)methyl]-6-[4-[(1R)-1-(2,2,2-trifluoroethoxy)ethyl]phenyl]-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 162211054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).