bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol

C214H232F4N48O26 — CID 161265328

About bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol

bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol (PubChem CID 161265328) has the molecular formula C214H232F4N48O26 and a molecular weight of 3968.51 g/mol. Its IUPAC name is bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol.

Molecular Properties

• Compound Name: bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol
• PubChem CID: 161265328
• Molecular Formula: C214H232F4N48O26
• Molecular Weight: 3968.51 g/mol
• Exact Mass: 3965.82
• IUPAC Name: bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol
• SMILES: COc1cccc2c1c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.COc1cccc2c1c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(C(F)(F)F)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(F)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccccc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c3c(C)cccc3n(CCNCC3OC(n4cnc5c(C)ncnc54)C(O)C3O)c2c1.Cc1ccc2c3c(C)cccc3n(CCNCC3OC(n4cnc5c(C)ncnc54)C(O)C3O)c2c1
• InChI: InChI=1S/C27H27F3N6O3.2C27H30N6O4.3C27H30N6O3.C26H27FN6O3.C26H28N6O3/c1-14-3-6-19-18(9-14)17-5-4-16(27(28,29)30)10-20(17)35(19)8-7-31-11-21-23(37)24(38)26(39-21)36-13-34-22-15(2)32-12-33-25(22)36;2*1-15-7-8-17-19(11-15)32(18-5-4-6-20(36-3)22(17)18)10-9-28-12-21-24(34)25(35)27(37-21)33-14-31-23-16(2)29-13-30-26(23)33;1-15-5-7-20-19(10-15)18-6-4-16(2)11-21(18)32(20)9-8-28-12-22-24(34)25(35)27(36-22)33-14-31-23-17(3)29-13-30-26(23)33;2*1-15-7-8-18-20(11-15)32(19-6-4-5-16(2)22(18)19)10-9-28-12-21-24(34)25(35)27(36-21)33-14-31-23-17(3)29-13-30-26(23)33;1-14-3-6-19-18(9-14)17-5-4-16(27)10-20(17)32(19)8-7-28-11-21-23(34)24(35)26(36-21)33-13-31-22-15(2)29-12-30-25(22)33;1-15-7-8-20-18(11-15)17-5-3-4-6-19(17)31(20)10-9-27-12-21-23(33)24(34)26(35-21)32-14-30-22-16(2)28-13-29-25(22)32/h3-6,9-10,12-13,21,23-24,26,31,37-38H,7-8,11H2,1-2H3;2*4-8,11,13-14,21,24-25,27-28,34-35H,9-10,12H2,1-3H3;4-7,10-11,13-14,22,24-25,27-28,34-35H,8-9,12H2,1-3H3;2*4-8,11,13-14,21,24-25,27-28,34-35H,9-10,12H2,1-3H3;3-6,9-10,12-13,21,23-24,26,28,34-35H,7-8,11H2,1-2H3;3-8,11,13-14,21,23-24,26-27,33-34H,9-10,12H2,1-2H3
• InChIKey: VDCJIMNXPHBPHA-UHFFFAOYSA-N
• XLogP: 21.78
• TPSA: 900.46 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 74
• Rotatable Bonds: 50
• Heavy Atoms: 292
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3968.51
LogP ≤ 5	21.78
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	74

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol?

The IUPAC name of bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol (CID 161265328) is bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol.

What is the SMILES notation for bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol?

The canonical SMILES for bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol is COc1cccc2c1c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.COc1cccc2c1c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(C(F)(F)F)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(C)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccc(F)cc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c(c1)c1ccccc1n2CCNCC1OC(n2cnc3c(C)ncnc32)C(O)C1O.Cc1ccc2c3c(C)cccc3n(CCNCC3OC(n4cnc5c(C)ncnc54)C(O)C3O)c2c1.Cc1ccc2c3c(C)cccc3n(CCNCC3OC(n4cnc5c(C)ncnc54)C(O)C3O)c2c1.

What is the InChIKey of bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol?

The InChIKey is VDCJIMNXPHBPHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27F3N6O3.2C27H30N6O4.3C27H30N6O3.C26H27FN6O3.C26H28N6O3/c1-14-3-6-19-18(9-14)17-5-4-16(27(28,29)30)10-20(17)35(19)8-7-31-11-21-23(37)24(38)26(39-21)36-13-34-22-15(2)32-12-33-25(22)36;2*1-15-7-8-17-19(11-15)32(18-5-4-6-20(36-3)22(17)18)10-9-28-12-21-24(34)25(35)27(37-21)33-14-31-23-16(2)29-13-30-26(23)33;1-15-5-7-20-19(10-15)18-6-4-16(2)11-21(18)32(20)9-8-28-12-22-24(34)25(35)27(36-22)33-14-31-23-17(3)29-13-30-26(23)33;2*1-15-7-8-18-20(11-15)32(19-6-4-5-16(2)22(18)19)10-9-28-12-21-24(34)25(35)27(36-21)33-14-31-23-17(3)29-13-30-26(23)33;1-14-3-6-19-18(9-14)17-5-4-16(27)10-20(17)32(19)8-7-28-11-21-23(34)24(35)26(36-21)33-13-31-22-15(2)29-12-30-25(22)33;1-15-7-8-20-18(11-15)17-5-3-4-6-19(17)31(20)10-9-27-12-21-23(33)24(34)26(35-21)32-14-30-22-16(2)28-13-29-25(22)32/h3-6,9-10,12-13,21,23-24,26,31,37-38H,7-8,11H2,1-2H3;2*4-8,11,13-14,21,24-25,27-28,34-35H,9-10,12H2,1-3H3;4-7,10-11,13-14,22,24-25,27-28,34-35H,8-9,12H2,1-3H3;2*4-8,11,13-14,21,24-25,27-28,34-35H,9-10,12H2,1-3H3;3-6,9-10,12-13,21,23-24,26,28,34-35H,7-8,11H2,1-2H3;3-8,11,13-14,21,23-24,26-27,33-34H,9-10,12H2,1-2H3.

What are the key properties of bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol?

bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol has a molecular weight of 3968.51 g/mol, XLogP of 21.78, 50 rotatable bonds, 24 hydrogen bond donors, and 74 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-[[2-(2,5-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(2,6-dimethylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-[[2-(2-fluoro-6-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;bis(2-[[2-(5-methoxy-2-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol);2-[[2-(3-methylcarbazol-9-yl)ethylamino]methyl]-5-(6-methylpurin-9-yl)oxolane-3,4-diol;2-(6-methylpurin-9-yl)-5-[[2-[6-methyl-2-(trifluoromethyl)carbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol is sourced from PubChem (CID 161265328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).