dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate

C134H189ClK2N20O23Si2 — CID 157234507

About dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate

dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate (PubChem CID 157234507) has the molecular formula C134H189ClK2N20O23Si2 and a molecular weight of 2617.92 g/mol. Its IUPAC name is dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate.

Molecular Properties

• Compound Name: dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate
• PubChem CID: 157234507
• Molecular Formula: C134H189ClK2N20O23Si2
• Molecular Weight: 2617.92 g/mol
• Exact Mass: 2615.27
• IUPAC Name: dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate
• SMILES: CC(C)(C)OC(=O)N(Cc1cnc(Cl)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCN(Cc3ccccc3)CC2CO)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCN(Cc3ccccc3)CC2CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCNCC2CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)nc1)C(=O)OC(C)(C)C.O=CO[O-].OCC1CN(Cc2ccccc2)CCN1.[H-].[K+].[K+]
• InChI: InChI=1S/C43H57N5O5Si.C36H51N5O5Si.C27H39N5O5.C15H22ClN3O4.C12H18N2O.CH2O3.2K.H/c1-41(2,3)52-39(49)48(40(50)53-42(4,5)6)30-34-27-44-38(45-28-34)47-26-25-46(29-33-19-13-10-14-20-33)31-35(47)32-51-54(43(7,8)9,36-21-15-11-16-22-36)37-23-17-12-18-24-37;1-34(2,3)45-32(42)41(33(43)46-35(4,5)6)25-27-22-38-31(39-23-27)40-21-20-37-24-28(40)26-44-47(36(7,8)9,29-16-12-10-13-17-29)30-18-14-11-15-19-30;1-26(2,3)36-24(34)32(25(35)37-27(4,5)6)17-21-14-28-23(29-15-21)31-13-12-30(18-22(31)19-33)16-20-10-8-7-9-11-20;1-14(2,3)22-12(20)19(13(21)23-15(4,5)6)9-10-7-17-11(16)18-8-10;15-10-12-9-14(7-6-13-12)8-11-4-2-1-3-5-11;2-1-4-3;;;/h10-24,27-28,35H,25-26,29-32H2,1-9H3;10-19,22-23,28,37H,20-21,24-26H2,1-9H3;7-11,14-15,22,33H,12-13,16-19H2,1-6H3;7-8H,9H2,1-6H3;1-5,12-13,15H,6-10H2;1,3H;;;/q;;;;;;2*+1;-1/p-1
• InChIKey: WQGWRFBFSUUFNW-UHFFFAOYSA-M
• XLogP: 13.56
• TPSA: 478.26 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 39
• Rotatable Bonds: 30
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2617.92
LogP ≤ 5	13.56
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate?

The IUPAC name of dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate (CID 157234507) is dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate.

What is the SMILES notation for dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate?

The canonical SMILES for dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate is CC(C)(C)OC(=O)N(Cc1cnc(Cl)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCN(Cc3ccccc3)CC2CO)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCN(Cc3ccccc3)CC2CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)nc1)C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(Cc1cnc(N2CCNCC2CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)nc1)C(=O)OC(C)(C)C.O=CO[O-].OCC1CN(Cc2ccccc2)CCN1.[H-].[K+].[K+].

What is the InChIKey of dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate?

The InChIKey is WQGWRFBFSUUFNW-UHFFFAOYSA-M. The full InChI is InChI=1S/C43H57N5O5Si.C36H51N5O5Si.C27H39N5O5.C15H22ClN3O4.C12H18N2O.CH2O3.2K.H/c1-41(2,3)52-39(49)48(40(50)53-42(4,5)6)30-34-27-44-38(45-28-34)47-26-25-46(29-33-19-13-10-14-20-33)31-35(47)32-51-54(43(7,8)9,36-21-15-11-16-22-36)37-23-17-12-18-24-37;1-34(2,3)45-32(42)41(33(43)46-35(4,5)6)25-27-22-38-31(39-23-27)40-21-20-37-24-28(40)26-44-47(36(7,8)9,29-16-12-10-13-17-29)30-18-14-11-15-19-30;1-26(2,3)36-24(34)32(25(35)37-27(4,5)6)17-21-14-28-23(29-15-21)31-13-12-30(18-22(31)19-33)16-20-10-8-7-9-11-20;1-14(2,3)22-12(20)19(13(21)23-15(4,5)6)9-10-7-17-11(16)18-8-10;15-10-12-9-14(7-6-13-12)8-11-4-2-1-3-5-11;2-1-4-3;;;/h10-24,27-28,35H,25-26,29-32H2,1-9H3;10-19,22-23,28,37H,20-21,24-26H2,1-9H3;7-11,14-15,22,33H,12-13,16-19H2,1-6H3;7-8H,9H2,1-6H3;1-5,12-13,15H,6-10H2;1,3H;;;/q;;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate?

dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate has a molecular weight of 2617.92 g/mol, XLogP of 13.56, 30 rotatable bonds, 4 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;(4-benzylpiperazin-2-yl)methanol;tert-butyl N-[[2-[4-benzyl-2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[4-benzyl-2-(hydroxymethyl)piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[[2-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]piperazin-1-yl]pyrimidin-5-yl]methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl N-[(2-chloropyrimidin-5-yl)methyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;hydride;oxido formate is sourced from PubChem (CID 157234507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).