tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane

C110H166F6I2N16O11Si4 — CID 158991527

IUPACtert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane
SMILESC.C.C.CC(C)(C)OC(=O)N1Cc2c(I)c(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)OC(=O)N1Cc2cc(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)[Si](C)(C)OCC1CNCc2cc(-c3cccc(F)c3)nn21.CF.CI.OCC1CNCc2cc(-c3cccc(F)c3)nn21.[C-]#[N+]c1c(-c2cccc(F)c2)nn2c1CN(C(=O)OC(C)(C)C)CC2CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C25H35FN4O3Si.C24H35FIN3O3Si.C24H36FN3O3Si.C19H28FN3OSi.C13H14FN3O.CH3F.CH3I.3CH4/c1-24(2,3)33-23(31)29-14-19(16-32-34(8,9)25(4,5)6)30-20(15-29)22(27-7)21(28-30)17-11-10-12-18(26)13-17;1-23(2,3)32-22(30)28-13-18(15-31-33(7,8)24(4,5)6)29-19(14-28)20(26)21(27-29)16-10-9-11-17(25)12-16;1-23(2,3)31-22(29)27-14-19-13-21(17-10-9-11-18(25)12-17)26-28(19)20(15-27)16-30-32(7,8)24(4,5)6;1-19(2,3)25(4,5)24-13-17-12-21-11-16-10-18(22-23(16)17)14-7-6-8-15(20)9-14;14-10-3-1-2-9(4-10)13-5-11-6-15-7-12(8-18)17(11)16-13;2*1-2;;;/h10-13,19H,14-16H2,1-6,8-9H3;9-12,18H,13-15H2,1-8H3;9-13,20H,14-16H2,1-8H3;6-10,17,21H,11-13H2,1-5H3;1-5,12,15,18H,6-8H2;2*1H3;3*1H4
InChIKeyJQFJGXASRXDMFE-UHFFFAOYSA-N
MW2368.78 g/mol
LogP28.39
Rot. Bonds18

About tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane

tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane (PubChem CID 158991527) has the molecular formula C110H166F6I2N16O11Si4 and a molecular weight of 2368.78 g/mol. Its IUPAC name is tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane.

Molecular Properties

Compound Nametert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane
PubChem CID158991527
Molecular FormulaC110H166F6I2N16O11Si4
Molecular Weight2368.78 g/mol
Exact Mass2367.00
IUPAC Nametert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane
SMILESC.C.C.CC(C)(C)OC(=O)N1Cc2c(I)c(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)OC(=O)N1Cc2cc(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)[Si](C)(C)OCC1CNCc2cc(-c3cccc(F)c3)nn21.CF.CI.OCC1CNCc2cc(-c3cccc(F)c3)nn21.[C-]#[N+]c1c(-c2cccc(F)c2)nn2c1CN(C(=O)OC(C)(C)C)CC2CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C25H35FN4O3Si.C24H35FIN3O3Si.C24H36FN3O3Si.C19H28FN3OSi.C13H14FN3O.CH3F.CH3I.3CH4/c1-24(2,3)33-23(31)29-14-19(16-32-34(8,9)25(4,5)6)30-20(15-29)22(27-7)21(28-30)17-11-10-12-18(26)13-17;1-23(2,3)32-22(30)28-13-18(15-31-33(7,8)24(4,5)6)29-19(14-28)20(26)21(27-29)16-10-9-11-17(25)12-16;1-23(2,3)31-22(29)27-14-19-13-21(17-10-9-11-18(25)12-17)26-28(19)20(15-27)16-30-32(7,8)24(4,5)6;1-19(2,3)25(4,5)24-13-17-12-21-11-16-10-18(22-23(16)17)14-7-6-8-15(20)9-14;14-10-3-1-2-9(4-10)13-5-11-6-15-7-12(8-18)17(11)16-13;2*1-2;;;/h10-13,19H,14-16H2,1-6,8-9H3;9-12,18H,13-15H2,1-8H3;9-13,20H,14-16H2,1-8H3;6-10,17,21H,11-13H2,1-5H3;1-5,12,15,18H,6-8H2;2*1H3;3*1H4
InChIKeyJQFJGXASRXDMFE-UHFFFAOYSA-N
XLogP28.39
TPSA263.29 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002368.78
LogP ≤ 528.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane with MolForge

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Related Compounds

tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;2-(3-fluorophenyl)-7-(hydroxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one;iodomethane;methane
CID 157719119
potassium;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-chlorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-chlorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-chlorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-carbamoyl-2-(3-chlorophenyl)-7-(hydroxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;carbanide;2-(3-chlorophenyl)-7-(hydroxymethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide;ethane;methane
CID 160098856
tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 3-carbamoyl-2-(3-fluorophenyl)-7-(hydroxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane
CID 161096689

Frequently Asked Questions

What is the IUPAC name of tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane?
The IUPAC name of tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane (CID 158991527) is tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane.
What is the SMILES notation for tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane?
The canonical SMILES for tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane is C.C.C.CC(C)(C)OC(=O)N1Cc2c(I)c(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)OC(=O)N1Cc2cc(-c3cccc(F)c3)nn2C(CO[Si](C)(C)C(C)(C)C)C1.CC(C)(C)[Si](C)(C)OCC1CNCc2cc(-c3cccc(F)c3)nn21.CF.CI.OCC1CNCc2cc(-c3cccc(F)c3)nn21.[C-]#[N+]c1c(-c2cccc(F)c2)nn2c1CN(C(=O)OC(C)(C)C)CC2CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane?
The InChIKey is JQFJGXASRXDMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H35FN4O3Si.C24H35FIN3O3Si.C24H36FN3O3Si.C19H28FN3OSi.C13H14FN3O.CH3F.CH3I.3CH4/c1-24(2,3)33-23(31)29-14-19(16-32-34(8,9)25(4,5)6)30-20(15-29)22(27-7)21(28-30)17-11-10-12-18(26)13-17;1-23(2,3)32-22(30)28-13-18(15-31-33(7,8)24(4,5)6)29-19(14-28)20(26)21(27-29)16-10-9-11-17(25)12-16;1-23(2,3)31-22(29)27-14-19-13-21(17-10-9-11-18(25)12-17)26-28(19)20(15-27)16-30-32(7,8)24(4,5)6;1-19(2,3)25(4,5)24-13-17-12-21-11-16-10-18(22-23(16)17)14-7-6-8-15(20)9-14;14-10-3-1-2-9(4-10)13-5-11-6-15-7-12(8-18)17(11)16-13;2*1-2;;;/h10-13,19H,14-16H2,1-6,8-9H3;9-12,18H,13-15H2,1-8H3;9-13,20H,14-16H2,1-8H3;6-10,17,21H,11-13H2,1-5H3;1-5,12,15,18H,6-8H2;2*1H3;3*1H4.
What are the key properties of tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane?
tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane has a molecular weight of 2368.78 g/mol, XLogP of 28.39, 18 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-iodo-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl 7-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-(3-fluorophenyl)-3-isocyano-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxylate;tert-butyl-[[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methoxy]-dimethylsilane;fluoromethane;[2-(3-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-7-yl]methanol;iodomethane;methane is sourced from PubChem (CID 158991527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).