potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide

C55H48Cl3KN24O5S2 — CID 159958113

About potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide

potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide (PubChem CID 159958113) has the molecular formula C55H48Cl3KN24O5S2 and a molecular weight of 1334.74 g/mol. Its IUPAC name is potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide.

Molecular Properties

• Compound Name: potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide
• PubChem CID: 159958113
• Molecular Formula: C55H48Cl3KN24O5S2
• Molecular Weight: 1334.74 g/mol
• Exact Mass: 1332.24
• IUPAC Name: potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide
• SMILES: Cc1ccc(S(=O)(=O)n2ccc3c(Cl)nc(Cl)nc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(Nc4ccn[nH]4)nc(Cl)nc32)cc1.Nc1ccc2cn[nH]c2c1.Nc1ccn[nH]1.[K+].[OH-].c1cc(Nc2nc(Nc3ccc4cn[nH]c4c3)nc3[nH]ccc23)[nH]n1
• InChI: InChI=1S/C16H13ClN6O2S.C16H13N9.C13H9Cl2N3O2S.C7H7N3.C3H5N3.K.H2O/c1-10-2-4-11(5-3-10)26(24,25)23-9-7-12-14(19-13-6-8-18-22-13)20-16(17)21-15(12)23;1-2-10(7-12-9(1)8-19-24-12)20-16-22-14-11(3-5-17-14)15(23-16)21-13-4-6-18-25-13;1-8-2-4-9(5-3-8)21(19,20)18-7-6-10-11(14)16-13(15)17-12(10)18;8-6-2-1-5-4-9-10-7(5)3-6;4-3-1-2-5-6-3;;/h2-9H,1H3,(H2,18,19,20,21,22);1-8H,(H,19,24)(H4,17,18,20,21,22,23,25);2-7H,1H3;1-4H,8H2,(H,9,10);1-2H,(H3,4,5,6);;1H2/q;;;;;+1;/p-1
• InChIKey: OCYZDNABGOKVHD-UHFFFAOYSA-M
• XLogP: 7.39
• TPSA: 432.80 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 23
• Rotatable Bonds: 10
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1334.74
LogP ≤ 5	7.39
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide?

The IUPAC name of potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide (CID 159958113) is potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide.

What is the SMILES notation for potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide?

The canonical SMILES for potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide is Cc1ccc(S(=O)(=O)n2ccc3c(Cl)nc(Cl)nc32)cc1.Cc1ccc(S(=O)(=O)n2ccc3c(Nc4ccn[nH]4)nc(Cl)nc32)cc1.Nc1ccc2cn[nH]c2c1.Nc1ccn[nH]1.[K+].[OH-].c1cc(Nc2nc(Nc3ccc4cn[nH]c4c3)nc3[nH]ccc23)[nH]n1.

What is the InChIKey of potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide?

The InChIKey is OCYZDNABGOKVHD-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H13ClN6O2S.C16H13N9.C13H9Cl2N3O2S.C7H7N3.C3H5N3.K.H2O/c1-10-2-4-11(5-3-10)26(24,25)23-9-7-12-14(19-13-6-8-18-22-13)20-16(17)21-15(12)23;1-2-10(7-12-9(1)8-19-24-12)20-16-22-14-11(3-5-17-14)15(23-16)21-13-4-6-18-25-13;1-8-2-4-9(5-3-8)21(19,20)18-7-6-10-11(14)16-13(15)17-12(10)18;8-6-2-1-5-4-9-10-7(5)3-6;4-3-1-2-5-6-3;;/h2-9H,1H3,(H2,18,19,20,21,22);1-8H,(H,19,24)(H4,17,18,20,21,22,23,25);2-7H,1H3;1-4H,8H2,(H,9,10);1-2H,(H3,4,5,6);;1H2/q;;;;;+1;/p-1.

What are the key properties of potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide?

potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide has a molecular weight of 1334.74 g/mol, XLogP of 7.39, 10 rotatable bonds, 11 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;2-chloro-7-(4-methylphenyl)sulfonyl-N-(1H-pyrazol-5-yl)pyrrolo[2,3-d]pyrimidin-4-amine;2,4-dichloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine;1H-indazol-6-amine;2-N-(1H-indazol-6-yl)-4-N-(1H-pyrazol-5-yl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine;1H-pyrazol-5-amine;hydroxide is sourced from PubChem (CID 159958113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).