C168H158F4N10O10 — CID 158800588
2,7-bis(4-methoxy-3,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;5,10-diethyl-2,7-bis[4-(4-methylphenoxy)phenyl]phenazine;2-(3,4-dimethoxyphenyl)-5,10-dimethyl-7-[4-(trifluoromethoxy)phenyl]phenazine;2-(3-fluoro-4-methoxyphenyl)-5,10-dimethyl-7-(4-methylphenyl)phenazine;2-(4-methoxyphenyl)-5,10-dimethyl-7-(4-phenoxyphenyl)phenazine (PubChem CID 158800588) has the molecular formula C168H158F4N10O10 and a molecular weight of 2553.16 g/mol. Its IUPAC name is 2,7-bis(4-methoxy-3,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;5,10-diethyl-2,7-bis[4-(4-methylphenoxy)phenyl]phenazine;2-(3,4-dimethoxyphenyl)-5,10-dimethyl-7-[4-(trifluoromethoxy)phenyl]phenazine;2-(3-fluoro-4-methoxyphenyl)-5,10-dimethyl-7-(4-methylphenyl)phenazine;2-(4-methoxyphenyl)-5,10-dimethyl-7-(4-phenoxyphenyl)phenazine.
| Compound Name | 2,7-bis(4-methoxy-3,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;5,10-diethyl-2,7-bis[4-(4-methylphenoxy)phenyl]phenazine;2-(3,4-dimethoxyphenyl)-5,10-dimethyl-7-[4-(trifluoromethoxy)phenyl]phenazine;2-(3-fluoro-4-methoxyphenyl)-5,10-dimethyl-7-(4-methylphenyl)phenazine;2-(4-methoxyphenyl)-5,10-dimethyl-7-(4-phenoxyphenyl)phenazine |
|---|---|
| PubChem CID | 158800588 |
| Molecular Formula | C168H158F4N10O10 |
| Molecular Weight | 2553.16 g/mol |
| Exact Mass | 2551.21 |
| IUPAC Name | 2,7-bis(4-methoxy-3,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;5,10-diethyl-2,7-bis[4-(4-methylphenoxy)phenyl]phenazine;2-(3,4-dimethoxyphenyl)-5,10-dimethyl-7-[4-(trifluoromethoxy)phenyl]phenazine;2-(3-fluoro-4-methoxyphenyl)-5,10-dimethyl-7-(4-methylphenyl)phenazine;2-(4-methoxyphenyl)-5,10-dimethyl-7-(4-phenoxyphenyl)phenazine |
| SMILES | CCN1c2ccc(-c3ccc(Oc4ccc(C)cc4)cc3)cc2N(CC)c2ccc(-c3ccc(Oc4ccc(C)cc4)cc3)cc21.COc1c(C)cc(-c2ccc3c(c2)N(C(C)C)c2ccc(-c4cc(C)c(OC)c(C)c4)cc2N3C(C)C)cc1C.COc1ccc(-c2ccc3c(c2)N(C)c2ccc(-c4ccc(C)cc4)cc2N3C)cc1F.COc1ccc(-c2ccc3c(c2)N(C)c2ccc(-c4ccc(OC(F)(F)F)cc4)cc2N3C)cc1OC.COc1ccc(-c2ccc3c(c2)N(C)c2ccc(-c4ccc(Oc5ccccc5)cc4)cc2N3C)cc1 |
| InChI | InChI=1S/C42H38N2O2.C36H42N2O2.C33H28N2O2.C29H25F3N2O3.C28H25FN2O/c1-5-43-39-25-15-34(32-13-23-38(24-14-32)46-36-19-9-30(4)10-20-36)28-42(39)44(6-2)40-26-16-33(27-41(40)43)31-11-21-37(22-12-31)45-35-17-7-29(3)8-18-35;1-21(2)37-31-13-11-28(30-17-25(7)36(40-10)26(8)18-30)20-34(31)38(22(3)4)32-14-12-27(19-33(32)37)29-15-23(5)35(39-9)24(6)16-29;1-34-31-20-14-26(24-11-17-29(18-12-24)37-28-7-5-4-6-8-28)22-33(31)35(2)30-19-13-25(21-32(30)34)23-9-15-27(36-3)16-10-23;1-33-24-13-8-20(21-9-14-27(35-3)28(17-21)36-4)16-26(24)34(2)23-12-7-19(15-25(23)33)18-5-10-22(11-6-18)37-29(30,31)32;1-18-5-7-19(8-6-18)21-9-12-24-26(16-21)30(2)25-13-10-22(17-27(25)31(24)3)20-11-14-28(32-4)23(29)15-20/h7-28H,5-6H2,1-4H3;11-22H,1-10H3;4-22H,1-3H3;5-17H,1-4H3;5-17H,1-4H3 |
| InChIKey | ITKWOXVXKWVMKA-UHFFFAOYSA-N |
| XLogP | 45.31 |
| TPSA | 124.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 20 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 192 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2553.16 |
| LogP ≤ 5 | 45.31 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 20 |