1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one

C216H237Cl5F6N18O29 — CID 159309663

IUPAC1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one
SMILESCC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1Cl.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1F.CCc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1.Cc1cc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1
InChIInChI=1S/C25H27FN2O4.C25H27FN2O3.C25H29FN2O3.C24H27ClN2O3.C24H27FN2O4.C24H27FN2O3.C23H24Cl2N2O3.C23H24ClFN2O3.C23H25ClN2O3/c1-17(19-5-6-19)16-32-22-10-9-21(15-23(22)30-2)28-13-12-27-24(25(28)29)31-14-11-18-3-7-20(26)8-4-18;1-17-15-22(9-10-23(17)31-16-18(2)20-5-6-20)28-13-12-27-24(25(28)29)30-14-11-19-3-7-21(26)8-4-19;1-5-19-16-21(10-11-22(19)31-17-25(2,3)4)28-14-13-27-23(24(28)29)30-15-12-18-6-8-20(26)9-7-18;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;1-24(2,3)16-31-20-10-9-19(15-21(20)29-4)27-13-12-26-22(23(27)28)30-14-11-17-5-7-18(25)8-6-17;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;2*1-23(2,3)15-30-20-9-8-18(14-19(20)25)27-12-11-26-21(22(27)28)29-13-10-16-4-6-17(24)7-5-16;1-23(2,3)16-29-20-10-8-19(9-11-20)26-14-13-25-21(22(26)27)28-15-12-17-4-6-18(24)7-5-17/h3-4,7-10,12-13,15,17,19H,5-6,11,14,16H2,1-2H3;3-4,7-10,12-13,15,18,20H,5-6,11,14,16H2,1-2H3;6-11,13-14,16H,5,12,15,17H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;2*4-9,11-12,14H,10,13,15H2,1-3H3;4-11,13-14H,12,15-16H2,1-3H3
InChIKeyLCJJOVGPZYGYCI-UHFFFAOYSA-N
MW3840.62 g/mol
LogP44.12
Rot. Bonds70

About 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one

1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one (PubChem CID 159309663) has the molecular formula C216H237Cl5F6N18O29 and a molecular weight of 3840.62 g/mol. Its IUPAC name is 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one.

Molecular Properties

Compound Name1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one
PubChem CID159309663
Molecular FormulaC216H237Cl5F6N18O29
Molecular Weight3840.62 g/mol
Exact Mass3835.60
IUPAC Name1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one
SMILESCC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1Cl.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1F.CCc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1.Cc1cc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1
InChIInChI=1S/C25H27FN2O4.C25H27FN2O3.C25H29FN2O3.C24H27ClN2O3.C24H27FN2O4.C24H27FN2O3.C23H24Cl2N2O3.C23H24ClFN2O3.C23H25ClN2O3/c1-17(19-5-6-19)16-32-22-10-9-21(15-23(22)30-2)28-13-12-27-24(25(28)29)31-14-11-18-3-7-20(26)8-4-18;1-17-15-22(9-10-23(17)31-16-18(2)20-5-6-20)28-13-12-27-24(25(28)29)30-14-11-19-3-7-21(26)8-4-19;1-5-19-16-21(10-11-22(19)31-17-25(2,3)4)28-14-13-27-23(24(28)29)30-15-12-18-6-8-20(26)9-7-18;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;1-24(2,3)16-31-20-10-9-19(15-21(20)29-4)27-13-12-26-22(23(27)28)30-14-11-17-5-7-18(25)8-6-17;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;2*1-23(2,3)15-30-20-9-8-18(14-19(20)25)27-12-11-26-21(22(27)28)29-13-10-16-4-6-17(24)7-5-16;1-23(2,3)16-29-20-10-8-19(9-11-20)26-14-13-25-21(22(26)27)28-15-12-17-4-6-18(24)7-5-17/h3-4,7-10,12-13,15,17,19H,5-6,11,14,16H2,1-2H3;3-4,7-10,12-13,15,18,20H,5-6,11,14,16H2,1-2H3;6-11,13-14,16H,5,12,15,17H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;2*4-9,11-12,14H,10,13,15H2,1-3H3;4-11,13-14H,12,15-16H2,1-3H3
InChIKeyLCJJOVGPZYGYCI-UHFFFAOYSA-N
XLogP44.12
TPSA498.61 Ų
H-Bond Donors
H-Bond Acceptors47
Rotatable Bonds70
Heavy Atoms274
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003840.62
LogP ≤ 544.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1047

Analyze 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one?
The IUPAC name of 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one (CID 159309663) is 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one.
What is the SMILES notation for 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one?
The canonical SMILES for 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one is CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1Cl.CC(C)(C)COc1ccc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)cc1F.CCc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.COc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1.Cc1cc(-n2ccnc(OCCc3ccc(Cl)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)(C)C.Cc1cc(-n2ccnc(OCCc3ccc(F)cc3)c2=O)ccc1OCC(C)C1CC1.
What is the InChIKey of 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one?
The InChIKey is LCJJOVGPZYGYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27FN2O4.C25H27FN2O3.C25H29FN2O3.C24H27ClN2O3.C24H27FN2O4.C24H27FN2O3.C23H24Cl2N2O3.C23H24ClFN2O3.C23H25ClN2O3/c1-17(19-5-6-19)16-32-22-10-9-21(15-23(22)30-2)28-13-12-27-24(25(28)29)31-14-11-18-3-7-20(26)8-4-18;1-17-15-22(9-10-23(17)31-16-18(2)20-5-6-20)28-13-12-27-24(25(28)29)30-14-11-19-3-7-21(26)8-4-19;1-5-19-16-21(10-11-22(19)31-17-25(2,3)4)28-14-13-27-23(24(28)29)30-15-12-18-6-8-20(26)9-7-18;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;1-24(2,3)16-31-20-10-9-19(15-21(20)29-4)27-13-12-26-22(23(27)28)30-14-11-17-5-7-18(25)8-6-17;1-17-15-20(9-10-21(17)30-16-24(2,3)4)27-13-12-26-22(23(27)28)29-14-11-18-5-7-19(25)8-6-18;2*1-23(2,3)15-30-20-9-8-18(14-19(20)25)27-12-11-26-21(22(27)28)29-13-10-16-4-6-17(24)7-5-16;1-23(2,3)16-29-20-10-8-19(9-11-20)26-14-13-25-21(22(26)27)28-15-12-17-4-6-18(24)7-5-17/h3-4,7-10,12-13,15,17,19H,5-6,11,14,16H2,1-2H3;3-4,7-10,12-13,15,18,20H,5-6,11,14,16H2,1-2H3;6-11,13-14,16H,5,12,15,17H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;5-10,12-13,15H,11,14,16H2,1-4H3;2*4-9,11-12,14H,10,13,15H2,1-3H3;4-11,13-14H,12,15-16H2,1-3H3.
What are the key properties of 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one?
1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one has a molecular weight of 3840.62 g/mol, XLogP of 44.12, 70 rotatable bonds, 0 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-4-(2,2-dimethylpropoxy)phenyl]-3-[2-(4-chlorophenyl)ethoxy]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-fluorophenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]pyrazin-2-one;3-[2-(4-chlorophenyl)ethoxy]-1-[4-(2,2-dimethylpropoxy)phenyl]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2-cyclopropylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-ethylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one;1-[4-(2,2-dimethylpropoxy)-3-methylphenyl]-3-[2-(4-fluorophenyl)ethoxy]pyrazin-2-one is sourced from PubChem (CID 159309663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).