5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine

C159H167F3N12O7 — CID 159012706

IUPAC5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine
SMILESCCCCN1c2ccc(-c3ccc(C)cc3)cc2N(CCCC)c2c1cccc2C(F)(F)F.CCN1c2ccc(-c3ccc(OCc4ccccc4)cc3)cc2N(CC)c2c(OC)cc(C)cc21.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccc(Oc4ccccc4)cc2N3C)c(C)c1.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C(C)C)c2ccccc2N3C(C)C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1
InChIInChI=1S/C31H32N2O2.C29H28N2O2.C28H31F3N2.C26H30N2O.C23H24N2O.C22H22N2O/c1-5-32-27-17-14-25(24-12-15-26(16-13-24)35-21-23-10-8-7-9-11-23)20-28(27)33(6-2)31-29(32)18-22(3)19-30(31)34-4;1-19-15-24(32-5)16-20(2)29(19)21-11-13-25-27(17-21)30(3)26-14-12-23(18-28(26)31(25)4)33-22-9-7-6-8-10-22;1-4-6-17-32-24-16-15-22(21-13-11-20(3)12-14-21)19-26(24)33(18-7-5-2)27-23(28(29,30)31)9-8-10-25(27)32;1-17(2)27-23-9-7-8-10-24(23)28(18(3)4)26-16-20(11-14-25(26)27)22-13-12-21(29-6)15-19(22)5;1-15-12-18(26-5)13-16(2)23(15)17-10-11-21-22(14-17)25(4)20-9-7-6-8-19(20)24(21)3;1-15-13-17(25-4)10-11-18(15)16-9-12-21-22(14-16)24(3)20-8-6-5-7-19(20)23(21)2/h7-20H,5-6,21H2,1-4H3;6-18H,1-5H3;8-16,19H,4-7,17-18H2,1-3H3;7-18H,1-6H3;6-14H,1-5H3;5-14H,1-4H3
InChIKeyJSRRUCYFESYCTH-UHFFFAOYSA-N
MW2415.16 g/mol
LogP42.80
Rot. Bonds26

About 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine

5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine (PubChem CID 159012706) has the molecular formula C159H167F3N12O7 and a molecular weight of 2415.16 g/mol. Its IUPAC name is 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine.

Molecular Properties

Compound Name5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine
PubChem CID159012706
Molecular FormulaC159H167F3N12O7
Molecular Weight2415.16 g/mol
Exact Mass2413.30
IUPAC Name5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine
SMILESCCCCN1c2ccc(-c3ccc(C)cc3)cc2N(CCCC)c2c1cccc2C(F)(F)F.CCN1c2ccc(-c3ccc(OCc4ccccc4)cc3)cc2N(CC)c2c(OC)cc(C)cc21.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccc(Oc4ccccc4)cc2N3C)c(C)c1.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C(C)C)c2ccccc2N3C(C)C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1
InChIInChI=1S/C31H32N2O2.C29H28N2O2.C28H31F3N2.C26H30N2O.C23H24N2O.C22H22N2O/c1-5-32-27-17-14-25(24-12-15-26(16-13-24)35-21-23-10-8-7-9-11-23)20-28(27)33(6-2)31-29(32)18-22(3)19-30(31)34-4;1-19-15-24(32-5)16-20(2)29(19)21-11-13-25-27(17-21)30(3)26-14-12-23(18-28(26)31(25)4)33-22-9-7-6-8-10-22;1-4-6-17-32-24-16-15-22(21-13-11-20(3)12-14-21)19-26(24)33(18-7-5-2)27-23(28(29,30)31)9-8-10-25(27)32;1-17(2)27-23-9-7-8-10-24(23)28(18(3)4)26-16-20(11-14-25(26)27)22-13-12-21(29-6)15-19(22)5;1-15-12-18(26-5)13-16(2)23(15)17-10-11-21-22(14-17)25(4)20-9-7-6-8-19(20)24(21)3;1-15-13-17(25-4)10-11-18(15)16-9-12-21-22(14-16)24(3)20-8-6-5-7-19(20)23(21)2/h7-20H,5-6,21H2,1-4H3;6-18H,1-5H3;8-16,19H,4-7,17-18H2,1-3H3;7-18H,1-6H3;6-14H,1-5H3;5-14H,1-4H3
InChIKeyJSRRUCYFESYCTH-UHFFFAOYSA-N
XLogP42.80
TPSA103.49 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds26
Heavy Atoms181
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002415.16
LogP ≤ 542.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine?
The IUPAC name of 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine (CID 159012706) is 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine.
What is the SMILES notation for 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine?
The canonical SMILES for 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine is CCCCN1c2ccc(-c3ccc(C)cc3)cc2N(CCCC)c2c1cccc2C(F)(F)F.CCN1c2ccc(-c3ccc(OCc4ccccc4)cc3)cc2N(CC)c2c(OC)cc(C)cc21.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccc(Oc4ccccc4)cc2N3C)c(C)c1.COc1cc(C)c(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C(C)C)c2ccccc2N3C(C)C)c(C)c1.COc1ccc(-c2ccc3c(c2)N(C)c2ccccc2N3C)c(C)c1.
What is the InChIKey of 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine?
The InChIKey is JSRRUCYFESYCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N2O2.C29H28N2O2.C28H31F3N2.C26H30N2O.C23H24N2O.C22H22N2O/c1-5-32-27-17-14-25(24-12-15-26(16-13-24)35-21-23-10-8-7-9-11-23)20-28(27)33(6-2)31-29(32)18-22(3)19-30(31)34-4;1-19-15-24(32-5)16-20(2)29(19)21-11-13-25-27(17-21)30(3)26-14-12-23(18-28(26)31(25)4)33-22-9-7-6-8-10-22;1-4-6-17-32-24-16-15-22(21-13-11-20(3)12-14-21)19-26(24)33(18-7-5-2)27-23(28(29,30)31)9-8-10-25(27)32;1-17(2)27-23-9-7-8-10-24(23)28(18(3)4)26-16-20(11-14-25(26)27)22-13-12-21(29-6)15-19(22)5;1-15-12-18(26-5)13-16(2)23(15)17-10-11-21-22(14-17)25(4)20-9-7-6-8-19(20)24(21)3;1-15-13-17(25-4)10-11-18(15)16-9-12-21-22(14-16)24(3)20-8-6-5-7-19(20)23(21)2/h7-20H,5-6,21H2,1-4H3;6-18H,1-5H3;8-16,19H,4-7,17-18H2,1-3H3;7-18H,1-6H3;6-14H,1-5H3;5-14H,1-4H3.
What are the key properties of 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine?
5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine has a molecular weight of 2415.16 g/mol, XLogP of 42.80, 26 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dibutyl-8-(4-methylphenyl)-1-(trifluoromethyl)phenazine;5,10-diethyl-1-methoxy-3-methyl-8-(4-phenylmethoxyphenyl)phenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2,6-dimethylphenyl)-5,10-dimethyl-7-phenoxyphenazine;2-(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2-(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine is sourced from PubChem (CID 159012706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).