(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one

C167H156Cl2F5N29O17 — CID 157079462

IUPAC(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one
SMILESCO[C@](C(=O)N1CCn2nc(OCc3ccccc3)cc2C1)(c1ccccc1)C(F)(F)F.Cc1cc(F)cc(C(=O)N2CCn3nc(OCc4cccc(F)c4)cc3C2)c1.Cc1ccc(C(=O)N2CCn3nc(OCc4ccnc(Cl)c4)cc3C2)cc1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)n1.O=C(c1ccccc1Cl)N1CCn2nc(OCc3ccccc3)cc2C1.[C-]#[N+]c1cc(COc2cc3n(n2)CCN(C(=O)c2ccc(C)cc2)C3)ccn1.[C-]#[N+]c1cccc(COc2cc3n(n2)CCN(C(=O)c2ccccc2)C3)c1
InChIInChI=1S/C23H22F3N3O3.C21H19F2N3O2.C21H19N5O2.C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H18ClN3O2.C20H20N4O2/c1-31-22(23(24,25)26,18-10-6-3-7-11-18)21(30)28-12-13-29-19(15-28)14-20(27-29)32-16-17-8-4-2-5-9-17;1-14-7-16(10-18(23)8-14)21(27)25-5-6-26-19(12-25)11-20(24-26)28-13-15-3-2-4-17(22)9-15;1-15-3-5-17(6-4-15)21(27)25-9-10-26-18(13-25)12-20(24-26)28-14-16-7-8-23-19(11-16)22-2;1-22-18-9-5-6-16(12-18)15-27-20-13-19-14-24(10-11-25(19)23-20)21(26)17-7-3-2-4-8-17;1-16-6-5-9-18(12-16)21(25)23-10-11-24-19(14-23)13-20(22-24)26-15-17-7-3-2-4-8-17;1-14-2-4-16(5-3-14)20(26)24-8-9-25-17(12-24)11-19(23-25)27-13-15-6-7-22-18(21)10-15;21-18-9-5-4-8-17(18)20(25)23-10-11-24-16(13-23)12-19(22-24)26-14-15-6-2-1-3-7-15;1-15-6-5-9-18(21-15)20(25)23-10-11-24-17(13-23)12-19(22-24)26-14-16-7-3-2-4-8-16/h2-11,14H,12-13,15-16H2,1H3;2-4,7-11H,5-6,12-13H2,1H3;3-8,11-12H,9-10,13-14H2,1H3;2-9,12-13H,10-11,14-15H2;2-9,12-13H,10-11,14-15H2,1H3;2-7,10-11H,8-9,12-13H2,1H3;1-9,12H,10-11,13-14H2;2-9,12H,10-11,13-14H2,1H3/t22-;;;;;;;/m0......./s1
InChIKeyADIZSXRUOMDXQG-CYQYKMECSA-N
MW3007.17 g/mol
LogP28.15
Rot. Bonds34

About (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one

(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one (PubChem CID 157079462) has the molecular formula C167H156Cl2F5N29O17 and a molecular weight of 3007.17 g/mol. Its IUPAC name is (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one.

Molecular Properties

Compound Name(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one
PubChem CID157079462
Molecular FormulaC167H156Cl2F5N29O17
Molecular Weight3007.17 g/mol
Exact Mass3004.15
IUPAC Name(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one
SMILESCO[C@](C(=O)N1CCn2nc(OCc3ccccc3)cc2C1)(c1ccccc1)C(F)(F)F.Cc1cc(F)cc(C(=O)N2CCn3nc(OCc4cccc(F)c4)cc3C2)c1.Cc1ccc(C(=O)N2CCn3nc(OCc4ccnc(Cl)c4)cc3C2)cc1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)n1.O=C(c1ccccc1Cl)N1CCn2nc(OCc3ccccc3)cc2C1.[C-]#[N+]c1cc(COc2cc3n(n2)CCN(C(=O)c2ccc(C)cc2)C3)ccn1.[C-]#[N+]c1cccc(COc2cc3n(n2)CCN(C(=O)c2ccccc2)C3)c1
InChIInChI=1S/C23H22F3N3O3.C21H19F2N3O2.C21H19N5O2.C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H18ClN3O2.C20H20N4O2/c1-31-22(23(24,25)26,18-10-6-3-7-11-18)21(30)28-12-13-29-19(15-28)14-20(27-29)32-16-17-8-4-2-5-9-17;1-14-7-16(10-18(23)8-14)21(27)25-5-6-26-19(12-25)11-20(24-26)28-13-15-3-2-4-17(22)9-15;1-15-3-5-17(6-4-15)21(27)25-9-10-26-18(13-25)12-20(24-26)28-14-16-7-8-23-19(11-16)22-2;1-22-18-9-5-6-16(12-18)15-27-20-13-19-14-24(10-11-25(19)23-20)21(26)17-7-3-2-4-8-17;1-16-6-5-9-18(12-16)21(25)23-10-11-24-19(14-23)13-20(22-24)26-15-17-7-3-2-4-8-17;1-14-2-4-16(5-3-14)20(26)24-8-9-25-17(12-24)11-19(23-25)27-13-15-6-7-22-18(21)10-15;21-18-9-5-4-8-17(18)20(25)23-10-11-24-16(13-23)12-19(22-24)26-14-15-6-2-1-3-7-15;1-15-6-5-9-18(21-15)20(25)23-10-11-24-17(13-23)12-19(22-24)26-14-16-7-3-2-4-8-16/h2-11,14H,12-13,15-16H2,1H3;2-4,7-11H,5-6,12-13H2,1H3;3-8,11-12H,9-10,13-14H2,1H3;2-9,12-13H,10-11,14-15H2;2-9,12-13H,10-11,14-15H2,1H3;2-7,10-11H,8-9,12-13H2,1H3;1-9,12H,10-11,13-14H2;2-9,12H,10-11,13-14H2,1H3/t22-;;;;;;;/m0......./s1
InChIKeyADIZSXRUOMDXQG-CYQYKMECSA-N
XLogP28.15
TPSA435.50 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds34
Heavy Atoms220
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003007.17
LogP ≤ 528.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one?
The IUPAC name of (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one (CID 157079462) is (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one.
What is the SMILES notation for (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one?
The canonical SMILES for (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one is CO[C@](C(=O)N1CCn2nc(OCc3ccccc3)cc2C1)(c1ccccc1)C(F)(F)F.Cc1cc(F)cc(C(=O)N2CCn3nc(OCc4cccc(F)c4)cc3C2)c1.Cc1ccc(C(=O)N2CCn3nc(OCc4ccnc(Cl)c4)cc3C2)cc1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)c1.Cc1cccc(C(=O)N2CCn3nc(OCc4ccccc4)cc3C2)n1.O=C(c1ccccc1Cl)N1CCn2nc(OCc3ccccc3)cc2C1.[C-]#[N+]c1cc(COc2cc3n(n2)CCN(C(=O)c2ccc(C)cc2)C3)ccn1.[C-]#[N+]c1cccc(COc2cc3n(n2)CCN(C(=O)c2ccccc2)C3)c1.
What is the InChIKey of (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one?
The InChIKey is ADIZSXRUOMDXQG-CYQYKMECSA-N. The full InChI is InChI=1S/C23H22F3N3O3.C21H19F2N3O2.C21H19N5O2.C21H18N4O2.C21H21N3O2.C20H19ClN4O2.C20H18ClN3O2.C20H20N4O2/c1-31-22(23(24,25)26,18-10-6-3-7-11-18)21(30)28-12-13-29-19(15-28)14-20(27-29)32-16-17-8-4-2-5-9-17;1-14-7-16(10-18(23)8-14)21(27)25-5-6-26-19(12-25)11-20(24-26)28-13-15-3-2-4-17(22)9-15;1-15-3-5-17(6-4-15)21(27)25-9-10-26-18(13-25)12-20(24-26)28-14-16-7-8-23-19(11-16)22-2;1-22-18-9-5-6-16(12-18)15-27-20-13-19-14-24(10-11-25(19)23-20)21(26)17-7-3-2-4-8-17;1-16-6-5-9-18(12-16)21(25)23-10-11-24-19(14-23)13-20(22-24)26-15-17-7-3-2-4-8-17;1-14-2-4-16(5-3-14)20(26)24-8-9-25-17(12-24)11-19(23-25)27-13-15-6-7-22-18(21)10-15;21-18-9-5-4-8-17(18)20(25)23-10-11-24-16(13-23)12-19(22-24)26-14-15-6-2-1-3-7-15;1-15-6-5-9-18(21-15)20(25)23-10-11-24-17(13-23)12-19(22-24)26-14-16-7-3-2-4-8-16/h2-11,14H,12-13,15-16H2,1H3;2-4,7-11H,5-6,12-13H2,1H3;3-8,11-12H,9-10,13-14H2,1H3;2-9,12-13H,10-11,14-15H2;2-9,12-13H,10-11,14-15H2,1H3;2-7,10-11H,8-9,12-13H2,1H3;1-9,12H,10-11,13-14H2;2-9,12H,10-11,13-14H2,1H3/t22-;;;;;;;/m0......./s1.
What are the key properties of (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one?
(2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one has a molecular weight of 3007.17 g/mol, XLogP of 28.15, 34 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;[2-[(2-chloro-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-fluoro-5-methylphenyl)-[2-[(3-fluorophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone;[2-[(3-isocyanophenyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-phenylmethanone;[2-[(2-isocyano-4-pyridinyl)methoxy]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(4-methylphenyl)methanone;(3-methylphenyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-1-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)propan-1-one is sourced from PubChem (CID 157079462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).