19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene

C220H134F2N18S4 — CID 159756363

About 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene

19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene (PubChem CID 159756363) has the molecular formula C220H134F2N18S4 and a molecular weight of 3195.88 g/mol. Its IUPAC name is 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene.

Molecular Properties

• Compound Name: 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene
• PubChem CID: 159756363
• Molecular Formula: C220H134F2N18S4
• Molecular Weight: 3195.88 g/mol
• Exact Mass: 3192.99
• IUPAC Name: 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene
• SMILES: CC1(C)c2ccccc2-c2cc3ccc4c(ccc5c4c4ccccc4n5-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3cc21.Cc1ccc(-c2cc(-c3ccc(C)cc3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)cc1.Fc1cccc(-c2nc(-c3cccc(F)c3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)cc1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)nc(-n4c5ccccc5c5ccc6c7ccc8c9ccccc9sc8c7ccc6c54)n3)ccc2c1
• InChI: InChI=1S/C50H29N3S.C44H30N4.C44H29N3S.C41H22F2N4S.C41H24N4S/c1-3-11-32-27-34(19-17-30(32)9-1)44-29-45(35-20-18-31-10-2-4-12-33(31)28-35)52-50(51-44)53-46-15-7-5-13-38(46)41-23-21-36-37-22-25-43-39-14-6-8-16-47(39)54-49(43)42(37)26-24-40(36)48(41)53;1-44(2)36-19-11-9-17-31(36)35-25-29-21-22-32-30(34(29)26-37(35)44)23-24-39-40(32)33-18-10-12-20-38(33)48(39)43-46-41(27-13-5-3-6-14-27)45-42(47-43)28-15-7-4-8-16-28;1-26-11-15-28(16-12-26)38-25-39(29-17-13-27(2)14-18-29)46-44(45-38)47-40-9-5-3-7-32(40)35-21-19-30-31-20-23-37-33-8-4-6-10-41(33)48-43(37)36(31)24-22-34(30)42(35)47;42-25-9-5-7-23(21-25)39-44-40(24-8-6-10-26(43)22-24)46-41(45-39)47-35-13-3-1-11-29(35)32-17-15-27-28-16-19-34-30-12-2-4-14-36(30)48-38(34)33(28)20-18-31(27)37(32)47;1-3-11-25(12-4-1)39-42-40(26-13-5-2-6-14-26)44-41(43-39)45-35-17-9-7-15-29(35)32-21-19-27-28-20-23-34-30-16-8-10-18-36(30)46-38(34)33(28)24-22-31(27)37(32)45/h1-29H;3-26H,1-2H3;3-25H,1-2H3;1-22H;1-24H
• InChIKey: NEHUOSPIHSAVSR-UHFFFAOYSA-N
• XLogP: 59.23
• TPSA: 192.22 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 15
• Heavy Atoms: 244
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3195.88
LogP ≤ 5	59.23
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene?

The IUPAC name of 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene (CID 159756363) is 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene.

What is the SMILES notation for 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene?

The canonical SMILES for 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene is CC1(C)c2ccccc2-c2cc3ccc4c(ccc5c4c4ccccc4n5-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3cc21.Cc1ccc(-c2cc(-c3ccc(C)cc3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)cc1.Fc1cccc(-c2nc(-c3cccc(F)c3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)c1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccc7c8ccccc8sc7c6ccc5c43)n2)cc1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)nc(-n4c5ccccc5c5ccc6c7ccc8c9ccccc9sc8c7ccc6c54)n3)ccc2c1.

What is the InChIKey of 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene?

The InChIKey is NEHUOSPIHSAVSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H29N3S.C44H30N4.C44H29N3S.C41H22F2N4S.C41H24N4S/c1-3-11-32-27-34(19-17-30(32)9-1)44-29-45(35-20-18-31-10-2-4-12-33(31)28-35)52-50(51-44)53-46-15-7-5-13-38(46)41-23-21-36-37-22-25-43-39-14-6-8-16-47(39)54-49(43)42(37)26-24-40(36)48(41)53;1-44(2)36-19-11-9-17-31(36)35-25-29-21-22-32-30(34(29)26-37(35)44)23-24-39-40(32)33-18-10-12-20-38(33)48(39)43-46-41(27-13-5-3-6-14-27)45-42(47-43)28-15-7-4-8-16-28;1-26-11-15-28(16-12-26)38-25-39(29-17-13-27(2)14-18-29)46-44(45-38)47-40-9-5-3-7-32(40)35-21-19-30-31-20-23-37-33-8-4-6-10-41(33)48-43(37)36(31)24-22-34(30)42(35)47;42-25-9-5-7-23(21-25)39-44-40(24-8-6-10-26(43)22-24)46-41(45-39)47-35-13-3-1-11-29(35)32-17-15-27-28-16-19-34-30-12-2-4-14-36(30)48-38(34)33(28)20-18-31(27)37(32)47;1-3-11-25(12-4-1)39-42-40(26-13-5-2-6-14-26)44-41(43-39)45-35-17-9-7-15-29(35)32-21-19-27-28-20-23-34-30-16-8-10-18-36(30)46-38(34)33(28)24-22-31(27)37(32)45/h1-29H;3-26H,1-2H3;3-25H,1-2H3;1-22H;1-24H.

What are the key properties of 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene?

19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene has a molecular weight of 3195.88 g/mol, XLogP of 59.23, 15 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 19-[4,6-bis(3-fluorophenyl)-1,3,5-triazin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-[4,6-bis(4-methylphenyl)pyrimidin-2-yl]-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;19-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene;25-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,5-dimethyl-25-azaheptacyclo[15.11.0.02,14.04,12.06,11.018,26.019,24]octacosa-1(17),2,4(12),6,8,10,13,15,18(26),19,21,23,27-tridecaene;19-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-thia-19-azaheptacyclo[15.11.0.02,14.05,13.06,11.018,26.020,25]octacosa-1(17),2(14),3,5(13),6,8,10,15,18(26),20,22,24,27-tridecaene is sourced from PubChem (CID 159756363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).