5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C164H161N31O17 — CID 160658373

IUPAC5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCC1CN(Cc2ccccc2)C(=O)c2cc(COc3ccccn3)nn21.Cc1cc(CN2CCn3nc(COc4ccccc4)cc3C2=O)no1.Cc1ccc([C@H](C)N2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccnc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1.Cc1cnc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1C.O=C1c2cc(COc3ccccn3)nn2CCN1Cc1ccccc1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C(C)CN(Cc2ccccc2)C3=O)c1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C[C@@H](C)N(Cc2ccccc2)C3=O)c1
InChIInChI=1S/2C22H20N4O2.C22H23N3O2.C21H22N4O2.2C20H20N4O2.C19H18N4O2.C18H18N4O3/c1-16-13-26-21(22(27)25(16)14-17-7-4-3-5-8-17)12-19(24-26)15-28-20-10-6-9-18(11-20)23-2;1-16-13-25(14-17-7-4-3-5-8-17)22(27)21-12-19(24-26(16)21)15-28-20-10-6-9-18(11-20)23-2;1-16-8-10-18(11-9-16)17(2)24-12-13-25-21(22(24)26)14-19(23-25)15-27-20-6-4-3-5-7-20;1-15-10-17(22-12-16(15)2)13-24-8-9-25-20(21(24)26)11-18(23-25)14-27-19-6-4-3-5-7-19;1-15-12-23(13-16-7-3-2-4-8-16)20(25)18-11-17(22-24(15)18)14-26-19-9-5-6-10-21-19;1-15-7-8-21-19(11-15)26-14-17-12-18-20(25)23(9-10-24(18)22-17)13-16-5-3-2-4-6-16;24-19-17-12-16(14-25-18-8-4-5-9-20-18)21-23(17)11-10-22(19)13-15-6-2-1-3-7-15;1-13-9-14(20-25-13)11-21-7-8-22-17(18(21)23)10-15(19-22)12-24-16-5-3-2-4-6-16/h2*3-12,16H,13-15H2,1H3;3-11,14,17H,12-13,15H2,1-2H3;3-7,10-12H,8-9,13-14H2,1-2H3;2-11,15H,12-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;1-9,12H,10-11,13-14H2;2-6,9-10H,7-8,11-12H2,1H3/t16-;;17-;;;;;/m1.0...../s1
InChIKeyRLIPVRGXBKUMAH-NDDNNCSZSA-N
MW2838.29 g/mol
LogP26.23
Rot. Bonds40

About 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 160658373) has the molecular formula C164H161N31O17 and a molecular weight of 2838.29 g/mol. Its IUPAC name is 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID160658373
Molecular FormulaC164H161N31O17
Molecular Weight2838.29 g/mol
Exact Mass2836.27
IUPAC Name5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCC1CN(Cc2ccccc2)C(=O)c2cc(COc3ccccn3)nn21.Cc1cc(CN2CCn3nc(COc4ccccc4)cc3C2=O)no1.Cc1ccc([C@H](C)N2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccnc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1.Cc1cnc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1C.O=C1c2cc(COc3ccccn3)nn2CCN1Cc1ccccc1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C(C)CN(Cc2ccccc2)C3=O)c1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C[C@@H](C)N(Cc2ccccc2)C3=O)c1
InChIInChI=1S/2C22H20N4O2.C22H23N3O2.C21H22N4O2.2C20H20N4O2.C19H18N4O2.C18H18N4O3/c1-16-13-26-21(22(27)25(16)14-17-7-4-3-5-8-17)12-19(24-26)15-28-20-10-6-9-18(11-20)23-2;1-16-13-25(14-17-7-4-3-5-8-17)22(27)21-12-19(24-26(16)21)15-28-20-10-6-9-18(11-20)23-2;1-16-8-10-18(11-9-16)17(2)24-12-13-25-21(22(24)26)14-19(23-25)15-27-20-6-4-3-5-7-20;1-15-10-17(22-12-16(15)2)13-24-8-9-25-20(21(24)26)11-18(23-25)14-27-19-6-4-3-5-7-19;1-15-12-23(13-16-7-3-2-4-8-16)20(25)18-11-17(22-24(15)18)14-26-19-9-5-6-10-21-19;1-15-7-8-21-19(11-15)26-14-17-12-18-20(25)23(9-10-24(18)22-17)13-16-5-3-2-4-6-16;24-19-17-12-16(14-25-18-8-4-5-9-20-18)21-23(17)11-10-22(19)13-15-6-2-1-3-7-15;1-13-9-14(20-25-13)11-21-7-8-22-17(18(21)23)10-15(19-22)12-24-16-5-3-2-4-6-16/h2*3-12,16H,13-15H2,1H3;3-11,14,17H,12-13,15H2,1-2H3;3-7,10-12H,8-9,13-14H2,1-2H3;2-11,15H,12-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;1-9,12H,10-11,13-14H2;2-6,9-10H,7-8,11-12H2,1H3/t16-;;17-;;;;;/m1.0...../s1
InChIKeyRLIPVRGXBKUMAH-NDDNNCSZSA-N
XLogP26.23
TPSA465.19 Ų
H-Bond Donors
H-Bond Acceptors38
Rotatable Bonds40
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002838.29
LogP ≤ 526.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

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

Analyze 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one 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 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 160658373) is 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is CC1CN(Cc2ccccc2)C(=O)c2cc(COc3ccccn3)nn21.Cc1cc(CN2CCn3nc(COc4ccccc4)cc3C2=O)no1.Cc1ccc([C@H](C)N2CCn3nc(COc4ccccc4)cc3C2=O)cc1.Cc1ccnc(OCc2cc3n(n2)CCN(Cc2ccccc2)C3=O)c1.Cc1cnc(CN2CCn3nc(COc4ccccc4)cc3C2=O)cc1C.O=C1c2cc(COc3ccccn3)nn2CCN1Cc1ccccc1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C(C)CN(Cc2ccccc2)C3=O)c1.[C-]#[N+]c1cccc(OCc2cc3n(n2)C[C@@H](C)N(Cc2ccccc2)C3=O)c1.
What is the InChIKey of 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is RLIPVRGXBKUMAH-NDDNNCSZSA-N. The full InChI is InChI=1S/2C22H20N4O2.C22H23N3O2.C21H22N4O2.2C20H20N4O2.C19H18N4O2.C18H18N4O3/c1-16-13-26-21(22(27)25(16)14-17-7-4-3-5-8-17)12-19(24-26)15-28-20-10-6-9-18(11-20)23-2;1-16-13-25(14-17-7-4-3-5-8-17)22(27)21-12-19(24-26(16)21)15-28-20-10-6-9-18(11-20)23-2;1-16-8-10-18(11-9-16)17(2)24-12-13-25-21(22(24)26)14-19(23-25)15-27-20-6-4-3-5-7-20;1-15-10-17(22-12-16(15)2)13-24-8-9-25-20(21(24)26)11-18(23-25)14-27-19-6-4-3-5-7-19;1-15-12-23(13-16-7-3-2-4-8-16)20(25)18-11-17(22-24(15)18)14-26-19-9-5-6-10-21-19;1-15-7-8-21-19(11-15)26-14-17-12-18-20(25)23(9-10-24(18)22-17)13-16-5-3-2-4-6-16;24-19-17-12-16(14-25-18-8-4-5-9-20-18)21-23(17)11-10-22(19)13-15-6-2-1-3-7-15;1-13-9-14(20-25-13)11-21-7-8-22-17(18(21)23)10-15(19-22)12-24-16-5-3-2-4-6-16/h2*3-12,16H,13-15H2,1H3;3-11,14,17H,12-13,15H2,1-2H3;3-7,10-12H,8-9,13-14H2,1-2H3;2-11,15H,12-14H2,1H3;2-8,11-12H,9-10,13-14H2,1H3;1-9,12H,10-11,13-14H2;2-6,9-10H,7-8,11-12H2,1H3/t16-;;17-;;;;;/m1.0...../s1.
What are the key properties of 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 2838.29 g/mol, XLogP of 26.23, 40 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-2-[(3-isocyanophenoxy)methyl]-7-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;(6R)-5-benzyl-2-[(3-isocyanophenoxy)methyl]-6-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-7-methyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-benzyl-2-(pyridin-2-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(4,5-dimethyl-2-pyridinyl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one;5-[(1S)-1-(4-methylphenyl)ethyl]-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 160658373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).