(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile

C164H153ClF3N29O17 — CID 162026833

IUPAC(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile
SMILESCOc1cccnc1CN1CCn2nc(COc3ccccc3)cc2C1=O.C[C@@H]1Cn2nc(COc3ccc(F)cc3)cc2C(=O)N1Cc1ccccc1.C[C@@H]1Cn2nc(COc3ccccc3)cc2C(=O)N1Cc1ncccc1Cl.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cn1.N#Cc1cccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)c1.O=C1c2cc(COc3ccccc3)nn2CCN1Cc1c(F)cccc1F.[C-]#[N+]c1cccc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1
InChIInChI=1S/C21H20FN3O2.2C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H17F2N3O2.C20H20N4O3.C20H20N4O2/c1-15-12-25-20(21(26)24(15)13-16-5-3-2-4-6-16)11-18(23-25)14-27-19-9-7-17(22)8-10-19;1-22-17-8-5-9-19(12-17)27-15-18-13-20-21(26)24(10-11-25(20)23-18)14-16-6-3-2-4-7-16;22-13-16-5-4-6-17(11-16)14-24-9-10-25-20(21(24)26)12-18(23-25)15-27-19-7-2-1-3-8-19;1-16-7-9-17(10-8-16)14-23-11-12-24-20(21(23)25)13-18(22-24)15-26-19-5-3-2-4-6-19;1-14-11-25-19(10-15(23-25)13-27-16-6-3-2-4-7-16)20(26)24(14)12-18-17(21)8-5-9-22-18;21-17-7-4-8-18(22)16(17)12-24-9-10-25-19(20(24)26)11-14(23-25)13-27-15-5-2-1-3-6-15;1-26-19-8-5-9-21-17(19)13-23-10-11-24-18(20(23)25)12-15(22-24)14-27-16-6-3-2-4-7-16;1-15-7-8-16(12-21-15)13-23-9-10-24-19(20(23)25)11-17(22-24)14-26-18-5-3-2-4-6-18/h2-11,15H,12-14H2,1H3;2-9,12-13H,10-11,14-15H2;1-8,11-12H,9-10,14-15H2;2-10,13H,11-12,14-15H2,1H3;2-10,14H,11-13H2,1H3;1-8,11H,9-10,12-13H2;2-9,12H,10-11,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3/t15-;;;;14-;;;/m1...1.../s1
InChIKeyYVMMEYHVSKZJJB-KQAPUUHVSA-N
MW2894.66 g/mol
LogP26.03
Rot. Bonds41

About (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile

(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile (PubChem CID 162026833) has the molecular formula C164H153ClF3N29O17 and a molecular weight of 2894.66 g/mol. Its IUPAC name is (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile.

Molecular Properties

Compound Name(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile
PubChem CID162026833
Molecular FormulaC164H153ClF3N29O17
Molecular Weight2894.66 g/mol
Exact Mass2892.16
IUPAC Name(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile
SMILESCOc1cccnc1CN1CCn2nc(COc3ccccc3)cc2C1=O.C[C@@H]1Cn2nc(COc3ccc(F)cc3)cc2C(=O)N1Cc1ccccc1.C[C@@H]1Cn2nc(COc3ccccc3)cc2C(=O)N1Cc1ncccc1Cl.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cn1.N#Cc1cccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)c1.O=C1c2cc(COc3ccccc3)nn2CCN1Cc1c(F)cccc1F.[C-]#[N+]c1cccc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1
InChIInChI=1S/C21H20FN3O2.2C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H17F2N3O2.C20H20N4O3.C20H20N4O2/c1-15-12-25-20(21(26)24(15)13-16-5-3-2-4-6-16)11-18(23-25)14-27-19-9-7-17(22)8-10-19;1-22-17-8-5-9-19(12-17)27-15-18-13-20-21(26)24(10-11-25(20)23-18)14-16-6-3-2-4-7-16;22-13-16-5-4-6-17(11-16)14-24-9-10-25-20(21(24)26)12-18(23-25)15-27-19-7-2-1-3-8-19;1-16-7-9-17(10-8-16)14-23-11-12-24-20(21(23)25)13-18(22-24)15-26-19-5-3-2-4-6-19;1-14-11-25-19(10-15(23-25)13-27-16-6-3-2-4-7-16)20(26)24(14)12-18-17(21)8-5-9-22-18;21-17-7-4-8-18(22)16(17)12-24-9-10-25-19(20(24)26)11-14(23-25)13-27-15-5-2-1-3-6-15;1-26-19-8-5-9-21-17(19)13-23-10-11-24-18(20(23)25)12-15(22-24)14-27-16-6-3-2-4-7-16;1-15-7-8-16(12-21-15)13-23-9-10-24-19(20(23)25)11-17(22-24)14-26-18-5-3-2-4-6-18/h2-11,15H,12-14H2,1H3;2-9,12-13H,10-11,14-15H2;1-8,11-12H,9-10,14-15H2;2-10,13H,11-12,14-15H2,1H3;2-10,14H,11-13H2,1H3;1-8,11H,9-10,12-13H2;2-9,12H,10-11,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3/t15-;;;;14-;;;/m1...1.../s1
InChIKeyYVMMEYHVSKZJJB-KQAPUUHVSA-N
XLogP26.03
TPSA454.93 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds41
Heavy Atoms214
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002894.66
LogP ≤ 526.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

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

Analyze (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile?
The IUPAC name of (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile (CID 162026833) is (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile.
What is the SMILES notation for (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile?
The canonical SMILES for (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile is COc1cccnc1CN1CCn2nc(COc3ccccc3)cc2C1=O.C[C@@H]1Cn2nc(COc3ccc(F)cc3)cc2C(=O)N1Cc1ccccc1.C[C@@H]1Cn2nc(COc3ccccc3)cc2C(=O)N1Cc1ncccc1Cl.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cn1.N#Cc1cccc(CN2CCn3nc(COc4ccccc4)cc3C2=O)c1.O=C1c2cc(COc3ccccc3)nn2CCN1Cc1c(F)cccc1F.[C-]#[N+]c1cccc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1.
What is the InChIKey of (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile?
The InChIKey is YVMMEYHVSKZJJB-KQAPUUHVSA-N. The full InChI is InChI=1S/C21H20FN3O2.2C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H17F2N3O2.C20H20N4O3.C20H20N4O2/c1-15-12-25-20(21(26)24(15)13-16-5-3-2-4-6-16)11-18(23-25)14-27-19-9-7-17(22)8-10-19;1-22-17-8-5-9-19(12-17)27-15-18-13-20-21(26)24(10-11-25(20)23-18)14-16-6-3-2-4-7-16;22-13-16-5-4-6-17(11-16)14-24-9-10-25-20(21(24)26)12-18(23-25)15-27-19-7-2-1-3-8-19;1-16-7-9-17(10-8-16)14-23-11-12-24-20(21(23)25)13-18(22-24)15-26-19-5-3-2-4-6-19;1-14-11-25-19(10-15(23-25)13-27-16-6-3-2-4-7-16)20(26)24(14)12-18-17(21)8-5-9-22-18;21-17-7-4-8-18(22)16(17)12-24-9-10-25-19(20(24)26)11-14(23-25)13-27-15-5-2-1-3-6-15;1-26-19-8-5-9-21-17(19)13-23-10-11-24-18(20(23)25)12-15(22-24)14-27-16-6-3-2-4-7-16;1-15-7-8-16(12-21-15)13-23-9-10-24-19(20(23)25)11-17(22-24)14-26-18-5-3-2-4-6-18/h2-11,15H,12-14H2,1H3;2-9,12-13H,10-11,14-15H2;1-8,11-12H,9-10,14-15H2;2-10,13H,11-12,14-15H2,1H3;2-10,14H,11-13H2,1H3;1-8,11H,9-10,12-13H2;2-9,12H,10-11,13-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3/t15-;;;;14-;;;/m1...1.../s1.
What are the key properties of (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile?
(6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile has a molecular weight of 2894.66 g/mol, XLogP of 26.03, 41 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-5-benzyl-2-[(4-fluorophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(3-isocyanophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-[(3-chloro-2-pyridinyl)methyl]-6-methyl-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(2,6-difluorophenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(3-methoxy-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4-methylphenyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(6-methyl-3-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;3-[[4-oxo-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]methyl]benzonitrile is sourced from PubChem (CID 162026833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).