3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline

C149H136F7N42O13P7 — CID 163920044

IUPAC3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline
SMILESCC(C)OP(C)(=O)c1ccc(-c2cnc3nnn(C(C)c4ccc5ncccc5c4)c3n2)cc1.CCP(=O)(OC)c1ccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)cc1.CCP(=O)(OC)c1ccc(-c2cnc3nnn(C(C)c4ccc5cccn5c4)c3n2)cc1.COP(C)(=O)c1ccc(-c2cnc3nnn(Cc4ccc5ccc(F)n5c4)c3n2)cc1.COP(C)(=O)c1cccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)c1.COP(C)(=O)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1.CP(C)(=O)Cn1cc(-c2cnc3nnn(C(F)(F)c4ccc5cccn5c4)c3n2)cn1
InChIInChI=1S/C25H25N6O2P.C23H20F2N5O2P.C23H23N6O2P.C22H18F2N5O2P.C21H18FN6O2P.C19H17F2N8OP.C16H15N6O2P/c1-16(2)33-34(4,32)21-10-7-18(8-11-21)23-15-27-24-25(28-23)31(30-29-24)17(3)19-9-12-22-20(14-19)6-5-13-26-22;1-3-33(31,32-2)19-10-6-16(7-11-19)20-12-13-21-26-27-22(30(21)28-20)23(24,25)17-8-9-18-5-4-14-29(18)15-17;1-4-32(30,31-3)20-11-8-17(9-12-20)21-14-24-22-23(25-21)29(27-26-22)16(2)18-7-10-19-6-5-13-28(19)15-18;1-31-32(2,30)18-7-3-5-15(13-18)19-10-11-20-25-26-21(29(20)27-19)22(23,24)16-8-9-17-6-4-12-28(17)14-16;1-30-31(2,29)17-8-4-15(5-9-17)18-11-23-20-21(24-18)28(26-25-20)13-14-3-6-16-7-10-19(22)27(16)12-14;1-31(2,30)12-28-10-13(8-23-28)16-9-22-17-18(24-16)29(26-25-17)19(20,21)14-5-6-15-4-3-7-27(15)11-14;1-24-25(2,23)14-9-18-15-16(19-14)22(21-20-15)10-11-5-6-13-12(8-11)4-3-7-17-13/h5-17H,1-4H3;4-15H,3H2,1-2H3;5-16H,4H2,1-3H3;3-14H,1-2H3;3-12H,13H2,1-2H3;3-11H,12H2,1-2H3;3-9H,10H2,1-2H3
InChIKeyQZQLEIMDGXEDIN-UHFFFAOYSA-N
MW3072.81 g/mol
LogP27.46
Rot. Bonds37

About 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline

3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline (PubChem CID 163920044) has the molecular formula C149H136F7N42O13P7 and a molecular weight of 3072.81 g/mol. Its IUPAC name is 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline.

Molecular Properties

Compound Name3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline
PubChem CID163920044
Molecular FormulaC149H136F7N42O13P7
Molecular Weight3072.81 g/mol
Exact Mass3070.93
IUPAC Name3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline
SMILESCC(C)OP(C)(=O)c1ccc(-c2cnc3nnn(C(C)c4ccc5ncccc5c4)c3n2)cc1.CCP(=O)(OC)c1ccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)cc1.CCP(=O)(OC)c1ccc(-c2cnc3nnn(C(C)c4ccc5cccn5c4)c3n2)cc1.COP(C)(=O)c1ccc(-c2cnc3nnn(Cc4ccc5ccc(F)n5c4)c3n2)cc1.COP(C)(=O)c1cccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)c1.COP(C)(=O)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1.CP(C)(=O)Cn1cc(-c2cnc3nnn(C(F)(F)c4ccc5cccn5c4)c3n2)cn1
InChIInChI=1S/C25H25N6O2P.C23H20F2N5O2P.C23H23N6O2P.C22H18F2N5O2P.C21H18FN6O2P.C19H17F2N8OP.C16H15N6O2P/c1-16(2)33-34(4,32)21-10-7-18(8-11-21)23-15-27-24-25(28-23)31(30-29-24)17(3)19-9-12-22-20(14-19)6-5-13-26-22;1-3-33(31,32-2)19-10-6-16(7-11-19)20-12-13-21-26-27-22(30(21)28-20)23(24,25)17-8-9-18-5-4-14-29(18)15-17;1-4-32(30,31-3)20-11-8-17(9-12-20)21-14-24-22-23(25-21)29(27-26-22)16(2)18-7-10-19-6-5-13-28(19)15-18;1-31-32(2,30)18-7-3-5-15(13-18)19-10-11-20-25-26-21(29(20)27-19)22(23,24)16-8-9-17-6-4-12-28(17)14-16;1-30-31(2,29)17-8-4-15(5-9-17)18-11-23-20-21(24-18)28(26-25-20)13-14-3-6-16-7-10-19(22)27(16)12-14;1-31(2,30)12-28-10-13(8-23-28)16-9-22-17-18(24-16)29(26-25-17)19(20,21)14-5-6-15-4-3-7-27(15)11-14;1-24-25(2,23)14-9-18-15-16(19-14)22(21-20-15)10-11-5-6-13-12(8-11)4-3-7-17-13/h5-17H,1-4H3;4-15H,3H2,1-2H3;5-16H,4H2,1-3H3;3-14H,1-2H3;3-12H,13H2,1-2H3;3-11H,12H2,1-2H3;3-9H,10H2,1-2H3
InChIKeyQZQLEIMDGXEDIN-UHFFFAOYSA-N
XLogP27.46
TPSA609.13 Ų
H-Bond Donors
H-Bond Acceptors55
Rotatable Bonds37
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003072.81
LogP ≤ 527.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1055

Computed Properties (RDKit)

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

Analyze 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline?
The IUPAC name of 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline (CID 163920044) is 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline.
What is the SMILES notation for 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline?
The canonical SMILES for 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline is CC(C)OP(C)(=O)c1ccc(-c2cnc3nnn(C(C)c4ccc5ncccc5c4)c3n2)cc1.CCP(=O)(OC)c1ccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)cc1.CCP(=O)(OC)c1ccc(-c2cnc3nnn(C(C)c4ccc5cccn5c4)c3n2)cc1.COP(C)(=O)c1ccc(-c2cnc3nnn(Cc4ccc5ccc(F)n5c4)c3n2)cc1.COP(C)(=O)c1cccc(-c2ccc3nnc(C(F)(F)c4ccc5cccn5c4)n3n2)c1.COP(C)(=O)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1.CP(C)(=O)Cn1cc(-c2cnc3nnn(C(F)(F)c4ccc5cccn5c4)c3n2)cn1.
What is the InChIKey of 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline?
The InChIKey is QZQLEIMDGXEDIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N6O2P.C23H20F2N5O2P.C23H23N6O2P.C22H18F2N5O2P.C21H18FN6O2P.C19H17F2N8OP.C16H15N6O2P/c1-16(2)33-34(4,32)21-10-7-18(8-11-21)23-15-27-24-25(28-23)31(30-29-24)17(3)19-9-12-22-20(14-19)6-5-13-26-22;1-3-33(31,32-2)19-10-6-16(7-11-19)20-12-13-21-26-27-22(30(21)28-20)23(24,25)17-8-9-18-5-4-14-29(18)15-17;1-4-32(30,31-3)20-11-8-17(9-12-20)21-14-24-22-23(25-21)29(27-26-22)16(2)18-7-10-19-6-5-13-28(19)15-18;1-31-32(2,30)18-7-3-5-15(13-18)19-10-11-20-25-26-21(29(20)27-19)22(23,24)16-8-9-17-6-4-12-28(17)14-16;1-30-31(2,29)17-8-4-15(5-9-17)18-11-23-20-21(24-18)28(26-25-20)13-14-3-6-16-7-10-19(22)27(16)12-14;1-31(2,30)12-28-10-13(8-23-28)16-9-22-17-18(24-16)29(26-25-17)19(20,21)14-5-6-15-4-3-7-27(15)11-14;1-24-25(2,23)14-9-18-15-16(19-14)22(21-20-15)10-11-5-6-13-12(8-11)4-3-7-17-13/h5-17H,1-4H3;4-15H,3H2,1-2H3;5-16H,4H2,1-3H3;3-14H,1-2H3;3-12H,13H2,1-2H3;3-11H,12H2,1-2H3;3-9H,10H2,1-2H3.
What are the key properties of 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline?
3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline has a molecular weight of 3072.81 g/mol, XLogP of 27.46, 37 rotatable bonds, 0 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[difluoro(indolizin-6-yl)methyl]-5-[1-(dimethylphosphorylmethyl)pyrazol-4-yl]triazolo[4,5-b]pyrazine;3-[difluoro(indolizin-6-yl)methyl]-6-[4-[ethyl(methoxy)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[difluoro(indolizin-6-yl)methyl]-6-[3-[methoxy(methyl)phosphoryl]phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;5-[4-[ethyl(methoxy)phosphoryl]phenyl]-3-(1-indolizin-6-ylethyl)triazolo[4,5-b]pyrazine;3-[(3-fluoroindolizin-6-yl)methyl]-5-[4-[methoxy(methyl)phosphoryl]phenyl]triazolo[4,5-b]pyrazine;6-[[5-[methoxy(methyl)phosphoryl]triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline;6-[1-[5-[4-[methyl(propan-2-yloxy)phosphoryl]phenyl]triazolo[4,5-b]pyrazin-3-yl]ethyl]quinoline is sourced from PubChem (CID 163920044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).