2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one

C107H79Cl5F7N17O6 — CID 162185586

IUPAC2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one
SMILESCN(C)CCNc1ccc(-c2nn(Cc3ccc(Cl)cc3)c(=O)c3ccccc23)c(F)n1.O=c1c2ccccc2c(-c2c(F)cc(F)nc2F)nn1Cc1ccc(Cl)cc1.O=c1c2ccccc2c(-c2ccc(CO)nc2F)nn1Cc1ccc(Cl)cc1.[2H]C([2H])(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O.[2H]C(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O
InChIInChI=1S/C24H23ClFN5O.C21H15ClFN3O2.2C21H15ClFN3O.C20H11ClF3N3O/c1-30(2)14-13-27-21-12-11-20(23(26)28-21)22-18-5-3-4-6-19(18)24(32)31(29-22)15-16-7-9-17(25)10-8-16;22-14-7-5-13(6-8-14)11-26-21(28)17-4-2-1-3-16(17)19(25-26)18-10-9-15(12-27)24-20(18)23;2*1-13-6-11-18(20(23)24-13)19-16-4-2-3-5-17(16)21(27)26(25-19)12-14-7-9-15(22)10-8-14;21-12-7-5-11(6-8-12)10-27-20(28)14-4-2-1-3-13(14)18(26-27)17-15(22)9-16(23)25-19(17)24/h3-12H,13-15H2,1-2H3,(H,27,28);1-10,27H,11-12H2;2*2-11H,12H2,1H3;1-9H,10H2/i;;12D2;12D;
InChIKeyZPPOJCFUTZQSRG-OUOCJFEPSA-N
MW2012.19 g/mol
LogP21.86
Rot. Bonds20

About 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one

2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one (PubChem CID 162185586) has the molecular formula C107H79Cl5F7N17O6 and a molecular weight of 2012.19 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one.

Molecular Properties

Compound Name2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one
PubChem CID162185586
Molecular FormulaC107H79Cl5F7N17O6
Molecular Weight2012.19 g/mol
Exact Mass2008.49
IUPAC Name2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one
SMILESCN(C)CCNc1ccc(-c2nn(Cc3ccc(Cl)cc3)c(=O)c3ccccc23)c(F)n1.O=c1c2ccccc2c(-c2c(F)cc(F)nc2F)nn1Cc1ccc(Cl)cc1.O=c1c2ccccc2c(-c2ccc(CO)nc2F)nn1Cc1ccc(Cl)cc1.[2H]C([2H])(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O.[2H]C(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O
InChIInChI=1S/C24H23ClFN5O.C21H15ClFN3O2.2C21H15ClFN3O.C20H11ClF3N3O/c1-30(2)14-13-27-21-12-11-20(23(26)28-21)22-18-5-3-4-6-19(18)24(32)31(29-22)15-16-7-9-17(25)10-8-16;22-14-7-5-13(6-8-14)11-26-21(28)17-4-2-1-3-16(17)19(25-26)18-10-9-15(12-27)24-20(18)23;2*1-13-6-11-18(20(23)24-13)19-16-4-2-3-5-17(16)21(27)26(25-19)12-14-7-9-15(22)10-8-14;21-12-7-5-11(6-8-12)10-27-20(28)14-4-2-1-3-13(14)18(26-27)17-15(22)9-16(23)25-19(17)24/h3-12H,13-15H2,1-2H3,(H,27,28);1-10,27H,11-12H2;2*2-11H,12H2,1H3;1-9H,10H2/i;;12D2;12D;
InChIKeyZPPOJCFUTZQSRG-OUOCJFEPSA-N
XLogP21.86
TPSA274.40 Ų
H-Bond Donors2
H-Bond Acceptors23
Rotatable Bonds20
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002012.19
LogP ≤ 521.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one with MolForge

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Related Compounds

4-[6-(Azetidin-1-yl)-2-fluoro-3-pyridinyl]-2-[(4-chlorophenyl)methyl]phthalazin-1-one;4-[6-(tert-butylamino)-2-fluoro-3-pyridinyl]-2-[(4-chlorophenyl)methyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-(cyclopropylamino)-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-(dimethylamino)-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(methoxymethylamino)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(oxetan-3-ylamino)-3-pyridinyl]phthalazin-1-one
CID 157081853
4-[[4-[5-Chloro-2-fluoro-6-(2-hydroxypropylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;4-[[4-[5-chloro-2-fluoro-6-(propylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;2-[(4-chlorophenyl)methyl]-6-fluoro-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;4-[[4-[2-fluoro-6-(2-hydroxypropylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;4-[[4-[2-fluoro-6-(propylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile
CID 157840631
4-[6-(Azetidin-1-yl)-2-fluoro-3-pyridinyl]-2-[(4-chlorophenyl)methyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-(cyclopropylamino)-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methoxy-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(oxetan-3-ylamino)-3-pyridinyl]phthalazin-1-one
CID 158238276
4-[[4-[5-Chloro-2-fluoro-6-(2-methoxyethylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(2-methoxyethylamino)-3-pyridinyl]phthalazin-1-one;[5-[3-[(4-cyanophenyl)methyl]-4-oxophthalazin-1-yl]-6-fluoro-2-pyridinyl]methyl acetate;4-[[4-[2-fluoro-6-(2-methoxyethylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;4-[[4-[2-fluoro-6-(morpholin-4-ylmethyl)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile;4-[[4-[2-fluoro-6-(oxan-4-ylmethylamino)-3-pyridinyl]-1-oxophthalazin-2-yl]methyl]benzonitrile
CID 158263165
6-Chloropyridine-2-carboxylic acid;(6-chloro-2-pyridinyl)-[4-(2-fluorophenyl)piperidin-1-yl]methanone;4-(2-fluorophenyl)piperidine;[4-(2-fluorophenyl)piperidin-1-yl]-(6-piperazin-1-yl-2-pyridinyl)methanone;methane;1-methylpiperazine
CID 158437530
2-[(4-Chlorophenyl)methyl]-4-(6-cyclopropyl-2-fluoro-3-pyridinyl)phthalazin-1-one;bis(2-[(4-chlorophenyl)methyl]-4-[6-(1,1-dideuterioethyl)-2-fluoro-3-pyridinyl]phthalazin-1-one);2-[(4-chlorophenyl)methyl]-4-[6-[(dimethylamino)methyl]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(methoxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one
CID 158746149
2-[(4-Chlorophenyl)methyl]-4-(6-cyclopropyl-2-fluoro-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-(1,1-dideuterioethyl)-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[(dimethylamino)methyl]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(methoxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one
CID 158798490
2-[(4-Chlorophenyl)-deuteriomethyl]-4-(2,6-difluoro-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2,6-difluoro-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(morpholin-4-ylmethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(oxan-4-ylmethylamino)-3-pyridinyl]phthalazin-1-one;[5-[3-[(4-chlorophenyl)methyl]-4-oxophthalazin-1-yl]-6-fluoro-2-pyridinyl]methyl acetate
CID 159407042
1-[4-[3-Chloro-2-(2-fluorophenyl)-7-(morpholin-4-ylmethyl)-8-(2-propan-2-ylphenyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]prop-2-en-1-one;3-chloro-2-(2-fluorophenyl)-5-piperazin-1-yl-8-(2-propan-2-ylphenyl)-1,6-naphthyridine-7-carbaldehyde;[3-chloro-2-(2-fluorophenyl)-5-piperazin-1-yl-8-(2-propan-2-ylphenyl)-1,6-naphthyridin-7-yl]methanol;methane;prop-2-enoyl chloride
CID 159488296
bis([4-(2-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-[6-(4-methylpiperazin-1-yl)-2-pyridinyl]methanone);4-(2-fluorophenyl)-1,2,3,6-tetrahydropyridine;6-(4-methylpiperazin-1-yl)pyridine-2-carbonyl chloride;6-(4-methylpiperazin-1-yl)pyridine-2-carboxylic acid;hydrochloride
CID 159800201
2-[(4-Chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methoxy-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one
CID 159917082
4-(6-Amino-2-fluoro-3-pyridinyl)-2-[(4-chlorophenyl)methyl]phthalazin-1-one;4-[6-(tert-butylamino)-2-fluoro-3-pyridinyl]-2-[(4-chlorophenyl)methyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-(dimethylamino)-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(methoxymethylamino)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(methylamino)-3-pyridinyl]phthalazin-1-one
CID 160137241

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one?
The IUPAC name of 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one (CID 162185586) is 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one.
What is the SMILES notation for 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one?
The canonical SMILES for 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one is CN(C)CCNc1ccc(-c2nn(Cc3ccc(Cl)cc3)c(=O)c3ccccc23)c(F)n1.O=c1c2ccccc2c(-c2c(F)cc(F)nc2F)nn1Cc1ccc(Cl)cc1.O=c1c2ccccc2c(-c2ccc(CO)nc2F)nn1Cc1ccc(Cl)cc1.[2H]C([2H])(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O.[2H]C(c1ccc(Cl)cc1)n1nc(-c2ccc(C)nc2F)c2ccccc2c1=O.
What is the InChIKey of 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one?
The InChIKey is ZPPOJCFUTZQSRG-OUOCJFEPSA-N. The full InChI is InChI=1S/C24H23ClFN5O.C21H15ClFN3O2.2C21H15ClFN3O.C20H11ClF3N3O/c1-30(2)14-13-27-21-12-11-20(23(26)28-21)22-18-5-3-4-6-19(18)24(32)31(29-22)15-16-7-9-17(25)10-8-16;22-14-7-5-13(6-8-14)11-26-21(28)17-4-2-1-3-16(17)19(25-26)18-10-9-15(12-27)24-20(18)23;2*1-13-6-11-18(20(23)24-13)19-16-4-2-3-5-17(16)21(27)26(25-19)12-14-7-9-15(22)10-8-14;21-12-7-5-11(6-8-12)10-27-20(28)14-4-2-1-3-13(14)18(26-27)17-15(22)9-16(23)25-19(17)24/h3-12H,13-15H2,1-2H3,(H,27,28);1-10,27H,11-12H2;2*2-11H,12H2,1H3;1-9H,10H2/i;;12D2;12D;.
What are the key properties of 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one?
2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one has a molecular weight of 2012.19 g/mol, XLogP of 21.86, 20 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)-deuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)-dideuteriomethyl]-4-(2-fluoro-6-methyl-3-pyridinyl)phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[6-[2-(dimethylamino)ethylamino]-2-fluoro-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-[2-fluoro-6-(hydroxymethyl)-3-pyridinyl]phthalazin-1-one;2-[(4-chlorophenyl)methyl]-4-(2,4,6-trifluoro-3-pyridinyl)phthalazin-1-one is sourced from PubChem (CID 162185586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).