bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone

C144H142BrCl4F6IN37O6P19 — CID 157203180

IUPACbis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone
SMILESCc1cnc(Cl)c(CC(=O)N2CCc3cc(-c4ccnc(Nc5ccnn5C)n4)cc(F)c32)c1.Cn1nccc1Nc1cc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ncccc2Cl)ccn1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccc(Cl)cc2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2cccc(Cl)c2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2Br)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2I)n1.PPP(P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P
InChIInChI=1S/C24H20BrFN6O.C24H21ClFN7O.3C24H20ClFN6O.C24H20FIN6O.H21P19/c1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)19(26)13-17)22(33)14-15-4-2-3-5-18(15)25;1-14-9-17(23(25)28-13-14)12-21(34)33-8-5-15-10-16(11-18(26)22(15)33)19-3-6-27-24(30-19)31-20-4-7-29-32(20)2;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-13-16-8-11-32(23(16)19(26)14-17)22(33)12-15-2-4-18(25)5-3-15;1-31-22(5-9-29-31)30-21-13-15(4-8-28-21)17-11-16-6-10-32(24(16)19(26)12-17)23(33)14-20-18(25)3-2-7-27-20;1-31-21(6-9-28-31)30-24-27-8-5-20(29-24)17-13-16-7-10-32(23(16)19(26)14-17)22(33)12-15-3-2-4-18(25)11-15;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)18(25)13-17)22(33)14-15-4-2-3-5-19(15)26;1-11-16(10)19(17(12(2)3)13(4)5)18(14(6)7)15(8)9/h2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);3-4,6-7,9-11,13H,5,8,12H2,1-2H3,(H,27,30,31);2-7,9-10,13-14H,8,11-12H2,1H3,(H,27,29,30);2-5,7-9,11-13H,6,10,14H2,1H3,(H,28,30);2-6,8-9,11,13-14H,7,10,12H2,1H3,(H,27,29,30);2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);11H,1-10H2
InChIKeyARAQHIAPCDOQOP-UHFFFAOYSA-N
MW3538.09 g/mol
LogP37.77
Rot. Bonds38

About bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone

bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone (PubChem CID 157203180) has the molecular formula C144H142BrCl4F6IN37O6P19 and a molecular weight of 3538.09 g/mol. Its IUPAC name is bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone.

Molecular Properties

Compound Namebis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone
PubChem CID157203180
Molecular FormulaC144H142BrCl4F6IN37O6P19
Molecular Weight3538.09 g/mol
Exact Mass3533.38
IUPAC Namebis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone
SMILESCc1cnc(Cl)c(CC(=O)N2CCc3cc(-c4ccnc(Nc5ccnn5C)n4)cc(F)c32)c1.Cn1nccc1Nc1cc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ncccc2Cl)ccn1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccc(Cl)cc2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2cccc(Cl)c2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2Br)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2I)n1.PPP(P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P
InChIInChI=1S/C24H20BrFN6O.C24H21ClFN7O.3C24H20ClFN6O.C24H20FIN6O.H21P19/c1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)19(26)13-17)22(33)14-15-4-2-3-5-18(15)25;1-14-9-17(23(25)28-13-14)12-21(34)33-8-5-15-10-16(11-18(26)22(15)33)19-3-6-27-24(30-19)31-20-4-7-29-32(20)2;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-13-16-8-11-32(23(16)19(26)14-17)22(33)12-15-2-4-18(25)5-3-15;1-31-22(5-9-29-31)30-21-13-15(4-8-28-21)17-11-16-6-10-32(24(16)19(26)12-17)23(33)14-20-18(25)3-2-7-27-20;1-31-21(6-9-28-31)30-24-27-8-5-20(29-24)17-13-16-7-10-32(23(16)19(26)14-17)22(33)12-15-3-2-4-18(25)11-15;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)18(25)13-17)22(33)14-15-4-2-3-5-19(15)26;1-11-16(10)19(17(12(2)3)13(4)5)18(14(6)7)15(8)9/h2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);3-4,6-7,9-11,13H,5,8,12H2,1-2H3,(H,27,30,31);2-7,9-10,13-14H,8,11-12H2,1H3,(H,27,29,30);2-5,7-9,11-13H,6,10,14H2,1H3,(H,28,30);2-6,8-9,11,13-14H,7,10,12H2,1H3,(H,27,29,30);2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);11H,1-10H2
InChIKeyARAQHIAPCDOQOP-UHFFFAOYSA-N
XLogP37.77
TPSA468.53 Ų
H-Bond Donors6
H-Bond Acceptors37
Rotatable Bonds38
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003538.09
LogP ≤ 537.77
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

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

Analyze bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone?
The IUPAC name of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone (CID 157203180) is bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone.
What is the SMILES notation for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone?
The canonical SMILES for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone is Cc1cnc(Cl)c(CC(=O)N2CCc3cc(-c4ccnc(Nc5ccnn5C)n4)cc(F)c32)c1.Cn1nccc1Nc1cc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ncccc2Cl)ccn1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccc(Cl)cc2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2cccc(Cl)c2)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2Br)n1.Cn1nccc1Nc1nccc(-c2cc(F)c3c(c2)CCN3C(=O)Cc2ccccc2I)n1.PPP(P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.
What is the InChIKey of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone?
The InChIKey is ARAQHIAPCDOQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20BrFN6O.C24H21ClFN7O.3C24H20ClFN6O.C24H20FIN6O.H21P19/c1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)19(26)13-17)22(33)14-15-4-2-3-5-18(15)25;1-14-9-17(23(25)28-13-14)12-21(34)33-8-5-15-10-16(11-18(26)22(15)33)19-3-6-27-24(30-19)31-20-4-7-29-32(20)2;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-13-16-8-11-32(23(16)19(26)14-17)22(33)12-15-2-4-18(25)5-3-15;1-31-22(5-9-29-31)30-21-13-15(4-8-28-21)17-11-16-6-10-32(24(16)19(26)12-17)23(33)14-20-18(25)3-2-7-27-20;1-31-21(6-9-28-31)30-24-27-8-5-20(29-24)17-13-16-7-10-32(23(16)19(26)14-17)22(33)12-15-3-2-4-18(25)11-15;1-31-21(7-10-28-31)30-24-27-9-6-20(29-24)17-12-16-8-11-32(23(16)18(25)13-17)22(33)14-15-4-2-3-5-19(15)26;1-11-16(10)19(17(12(2)3)13(4)5)18(14(6)7)15(8)9/h2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);3-4,6-7,9-11,13H,5,8,12H2,1-2H3,(H,27,30,31);2-7,9-10,13-14H,8,11-12H2,1H3,(H,27,29,30);2-5,7-9,11-13H,6,10,14H2,1H3,(H,28,30);2-6,8-9,11,13-14H,7,10,12H2,1H3,(H,27,29,30);2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,29,30);11H,1-10H2.
What are the key properties of bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone?
bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone has a molecular weight of 3538.09 g/mol, XLogP of 37.77, 38 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[diphosphanyl(phosphanyl)phosphanyl]phosphane;2-(2-bromophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(2-chloro-5-methyl-3-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(4-chlorophenyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]ethanone;2-(3-chloro-2-pyridinyl)-1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]-4-pyridinyl]-2,3-dihydroindol-1-yl]ethanone;1-[7-fluoro-5-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-2,3-dihydroindol-1-yl]-2-(2-iodophenyl)ethanone is sourced from PubChem (CID 157203180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).