potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride

C61H89B2BrClF6KN16O11S4 — CID 158142074

About potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride

potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride (PubChem CID 158142074) has the molecular formula C61H89B2BrClF6KN16O11S4 and a molecular weight of 1640.82 g/mol. Its IUPAC name is potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride.

Molecular Properties

• Compound Name: potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride
• PubChem CID: 158142074
• Molecular Formula: C61H89B2BrClF6KN16O11S4
• Molecular Weight: 1640.82 g/mol
• Exact Mass: 1638.44
• IUPAC Name: potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride
• SMILES: CCNC(=O)C1CCN(Cc2csc3c(-c4cnc(OC)c(NS(C)(=O)=O)c4)nc(N4CCOCC4)nc23)CC1.CCNC(=O)C1CCNCC1.CCNC(=O)C1CC[NH+](C[B-](F)(F)F)CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)csc23)cc1NS(C)(=O)=O.FB(F)CCl.[F-].[K+]
• InChI: InChI=1S/C26H35N7O5S2.C17H18BrN5O4S2.C9H17BF3N2O.C8H16N2O.CH2BClF2.FH.K/c1-4-27-24(34)17-5-7-32(8-6-17)15-19-16-39-23-21(29-26(30-22(19)23)33-9-11-38-12-10-33)18-13-20(31-40(3,35)36)25(37-2)28-14-18;1-26-16-12(22-29(2,24)25)7-10(8-19-16)13-15-14(11(18)9-28-15)21-17(20-13)23-3-5-27-6-4-23;1-2-14-9(16)8-3-5-15(6-4-8)7-10(11,12)13;1-2-10-8(11)7-3-5-9-6-4-7;3-1-2(4)5;;/h13-14,16-17,31H,4-12,15H2,1-3H3,(H,27,34);7-9,22H,3-6H2,1-2H3;8H,2-7H2,1H3,(H,14,16);7,9H,2-6H2,1H3,(H,10,11);1H2;1H;/q;;-1;;;;+1
• InChIKey: OGKVHQAJYKKMNG-UHFFFAOYSA-N
• XLogP: 0.18
• TPSA: 320.09 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 23
• Rotatable Bonds: 21
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1640.82
LogP ≤ 5	0.18
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride?

The IUPAC name of potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride (CID 158142074) is potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride.

What is the SMILES notation for potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride?

The canonical SMILES for potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride is CCNC(=O)C1CCN(Cc2csc3c(-c4cnc(OC)c(NS(C)(=O)=O)c4)nc(N4CCOCC4)nc23)CC1.CCNC(=O)C1CCNCC1.CCNC(=O)C1CC[NH+](C[B-](F)(F)F)CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)csc23)cc1NS(C)(=O)=O.FB(F)CCl.[F-].[K+].

What is the InChIKey of potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride?

The InChIKey is OGKVHQAJYKKMNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35N7O5S2.C17H18BrN5O4S2.C9H17BF3N2O.C8H16N2O.CH2BClF2.FH.K/c1-4-27-24(34)17-5-7-32(8-6-17)15-19-16-39-23-21(29-26(30-22(19)23)33-9-11-38-12-10-33)18-13-20(31-40(3,35)36)25(37-2)28-14-18;1-26-16-12(22-29(2,24)25)7-10(8-19-16)13-15-14(11(18)9-28-15)21-17(20-13)23-3-5-27-6-4-23;1-2-14-9(16)8-3-5-15(6-4-8)7-10(11,12)13;1-2-10-8(11)7-3-5-9-6-4-7;3-1-2(4)5;;/h13-14,16-17,31H,4-12,15H2,1-3H3,(H,27,34);7-9,22H,3-6H2,1-2H3;8H,2-7H2,1H3,(H,14,16);7,9H,2-6H2,1H3,(H,10,11);1H2;1H;/q;;-1;;;;+1.

What are the key properties of potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride?

potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride has a molecular weight of 1640.82 g/mol, XLogP of 0.18, 21 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;N-[5-(7-bromo-2-morpholin-4-ylthieno[3,2-d]pyrimidin-4-yl)-2-methoxy-3-pyridinyl]methanesulfonamide;chloromethyl(difluoro)borane;[4-(ethylcarbamoyl)piperidin-1-ium-1-yl]methyl-trifluoroboranuide;N-ethyl-1-[[4-[5-(methanesulfonamido)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidine-4-carboxamide;N-ethylpiperidine-4-carboxamide;fluoride is sourced from PubChem (CID 158142074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).