19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)
C168H188N16Y4-8 — CID 158053839
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)
SMILESCC.CC.CC.CC.CC.CC.Cc1n[c-]c(-c2[c-]c3ccccc3c3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]c3ccccc3cc2)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]ccc3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]cccc2)c(C(C)(C)C)n1.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2c2ccccc2c2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2ccc2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccc3ccccc3c1-2.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccccc1-2.[Y].[Y].[Y].[Y]
InChIInChI=1S/C24H22N2.C23H20N2.2C20H20N2.2C19H18N2.C16H18N2.C15H16N2.6C2H6.4Y/c1-14-25-22-20(23(26-14)24(2,3)4)13-19-17-11-6-5-9-15(17)16-10-7-8-12-18(16)21(19)22;1-15-24-14-21(22(25-15)23(2,3)4)20-13-16-9-5-6-10-17(16)18-11-7-8-12-19(18)20;1-12-21-18-16(19(22-12)20(2,3)4)11-14-10-9-13-7-5-6-8-15(13)17(14)18;1-12-21-18-15-10-9-13-7-5-6-8-14(13)16(15)11-17(18)19(22-12)20(2,3)4;1-13-20-12-17(18(21-13)19(2,3)4)16-11-7-9-14-8-5-6-10-15(14)16;1-13-20-12-17(18(21-13)19(2,3)4)16-10-9-14-7-5-6-8-15(14)11-16;1-10-17-14-12-8-6-5-7-11(12)9-13(14)15(18-10)16(2,3)4;1-11-16-10-13(12-8-6-5-7-9-12)14(17-11)15(2,3)4;6*1-2;;;;/h5-12H,13H2,1-4H3;5-12H,1-4H3;2*5-10H,11H2,1-4H3;2*5-10H,1-4H3;5-8H,9H2,1-4H3;5-8H,1-4H3;6*1-2H3;;;;/q;-2;;;2*-2;;-2;;;;;;;;;;
InChIKeyBBIPZVQGVXORND-UHFFFAOYSA-N
MW2787.09 g/mol
LogP43.39
Rot. Bonds4
About 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)
19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) (PubChem CID 158053839) has the molecular formula C168H188N16Y4-8 and a molecular weight of 2787.09 g/mol. Its IUPAC name is 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium).
Molecular Properties
| Compound Name | 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) |
|---|---|
| PubChem CID | 158053839 |
| Molecular Formula | C168H188N16Y4-8 |
| Molecular Weight | 2787.09 g/mol |
| Exact Mass | 2785.15 |
| IUPAC Name | 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) |
| SMILES | CC.CC.CC.CC.CC.CC.Cc1n[c-]c(-c2[c-]c3ccccc3c3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]c3ccccc3cc2)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]ccc3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]cccc2)c(C(C)(C)C)n1.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2c2ccccc2c2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2ccc2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccc3ccccc3c1-2.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccccc1-2.[Y].[Y].[Y].[Y] |
| InChI | InChI=1S/C24H22N2.C23H20N2.2C20H20N2.2C19H18N2.C16H18N2.C15H16N2.6C2H6.4Y/c1-14-25-22-20(23(26-14)24(2,3)4)13-19-17-11-6-5-9-15(17)16-10-7-8-12-18(16)21(19)22;1-15-24-14-21(22(25-15)23(2,3)4)20-13-16-9-5-6-10-17(16)18-11-7-8-12-19(18)20;1-12-21-18-16(19(22-12)20(2,3)4)11-14-10-9-13-7-5-6-8-15(13)17(14)18;1-12-21-18-15-10-9-13-7-5-6-8-14(13)16(15)11-17(18)19(22-12)20(2,3)4;1-13-20-12-17(18(21-13)19(2,3)4)16-11-7-9-14-8-5-6-10-15(14)16;1-13-20-12-17(18(21-13)19(2,3)4)16-10-9-14-7-5-6-8-15(14)11-16;1-10-17-14-12-8-6-5-7-11(12)9-13(14)15(18-10)16(2,3)4;1-11-16-10-13(12-8-6-5-7-9-12)14(17-11)15(2,3)4;6*1-2;;;;/h5-12H,13H2,1-4H3;5-12H,1-4H3;2*5-10H,11H2,1-4H3;2*5-10H,1-4H3;5-8H,9H2,1-4H3;5-8H,1-4H3;6*1-2H3;;;;/q;-2;;;2*-2;;-2;;;;;;;;;; |
| InChIKey | BBIPZVQGVXORND-UHFFFAOYSA-N |
| XLogP | 43.39 |
| TPSA | 206.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 188 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2787.09 |
| LogP ≤ 5 | 43.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)?
The IUPAC name of 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) (CID 158053839) is 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium).
What is the SMILES notation for 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)?
The canonical SMILES for 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) is CC.CC.CC.CC.CC.CC.Cc1n[c-]c(-c2[c-]c3ccccc3c3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]c3ccccc3cc2)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]ccc3ccccc23)c(C(C)(C)C)n1.Cc1n[c-]c(-c2[c-]cccc2)c(C(C)(C)C)n1.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2c2ccccc2c2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1c-2ccc2ccccc12.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccc3ccccc3c1-2.Cc1nc2c(c(C(C)(C)C)n1)Cc1ccccc1-2.[Y].[Y].[Y].[Y].
What is the InChIKey of 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)?
The InChIKey is BBIPZVQGVXORND-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2.C23H20N2.2C20H20N2.2C19H18N2.C16H18N2.C15H16N2.6C2H6.4Y/c1-14-25-22-20(23(26-14)24(2,3)4)13-19-17-11-6-5-9-15(17)16-10-7-8-12-18(16)21(19)22;1-15-24-14-21(22(25-15)23(2,3)4)20-13-16-9-5-6-10-17(16)18-11-7-8-12-19(18)20;1-12-21-18-16(19(22-12)20(2,3)4)11-14-10-9-13-7-5-6-8-15(13)17(14)18;1-12-21-18-15-10-9-13-7-5-6-8-14(13)16(15)11-17(18)19(22-12)20(2,3)4;1-13-20-12-17(18(21-13)19(2,3)4)16-11-7-9-14-8-5-6-10-15(14)16;1-13-20-12-17(18(21-13)19(2,3)4)16-10-9-14-7-5-6-8-15(14)11-16;1-10-17-14-12-8-6-5-7-11(12)9-13(14)15(18-10)16(2,3)4;1-11-16-10-13(12-8-6-5-7-9-12)14(17-11)15(2,3)4;6*1-2;;;;/h5-12H,13H2,1-4H3;5-12H,1-4H3;2*5-10H,11H2,1-4H3;2*5-10H,1-4H3;5-8H,9H2,1-4H3;5-8H,1-4H3;6*1-2H3;;;;/q;-2;;;2*-2;;-2;;;;;;;;;;.
What are the key properties of 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium)?
19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) has a molecular weight of 2787.09 g/mol, XLogP of 43.39, 4 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 19-tert-butyl-17-methyl-16,18-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene;13-tert-butyl-15-methyl-14,16-diazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2,4,6,8,12(17),13,15-octaene;15-tert-butyl-13-methyl-12,14-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;4-tert-butyl-2-methyl-5H-indeno[1,2-d]pyrimidine;6-tert-butyl-2-methyl-5-(1H-naphthalen-1-id-2-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(2H-naphthalen-2-id-1-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-(10H-phenanthren-10-id-9-yl)-4H-pyrimidin-4-ide;6-tert-butyl-2-methyl-5-phenyl-4H-pyrimidin-4-ide;ethane;tetrakis(yttrium) is sourced from PubChem (CID 158053839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 158053839 — identifiers, structure, computed properties (public domain)
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