potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide

C126H137BBrCl4F4KN11O21P9 — CID 161210626

IUPACpotassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide
SMILESC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOC(=O)c1nn2c(c1-c1ccc(Cl)cc1C)OC[C@@H](F)C2.CCOC(=O)c1nn2c(c1Br)OC[C@@H](F)C2.CO.Cc1cc(Cl)ccc1-c1c(C(=O)NC2CC2)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1-c1c(C(=O)O)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1B(O)O.NC1CC1.PP(P)P(P)P.[K+].[OH-]
InChIInChI=1S/C21H4.C20H6.C17H17ClFN3O2.C16H16ClFN2O3.C14H12ClFN2O3.C9H10BrFN2O3.C9H21O6P3.C8H19N.C7H8BClO2.C3H7N.CH4O.CH4.K.H2O.H8P6/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2;1-9-6-10(18)2-5-13(9)14-15(16(23)20-12-3-4-12)21-22-7-11(19)8-24-17(14)22;1-3-22-16(21)14-13(12-5-4-10(17)6-9(12)2)15-20(19-14)7-11(18)8-23-15;1-7-4-8(15)2-3-10(7)11-12(14(19)20)17-18-5-9(16)6-21-13(11)18;1-2-15-9(14)7-6(10)8-13(12-7)3-5(11)4-16-8;1-4-7-16(10)13-17(11,8-5-2)15-18(12,14-16)9-6-3;1-6-9(7(2)3)8(4)5;1-5-4-6(9)2-3-7(5)8(10)11;4-3-1-2-3;1-2;;;;1-5(2)6(3)4/h1H,2H3;1-2H3;2,5-6,11-12H,3-4,7-8H2,1H3,(H,20,23);4-6,11H,3,7-8H2,1-2H3;2-4,9H,5-6H2,1H3,(H,19,20);5H,2-4H2,1H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;2-4,10-11H,1H3;3H,1-2,4H2;2H,1H3;1H4;;1H2;1-4H2/q;;;;;;;;;;;;+1;;/p-1/t;;2*11-;9-;5-;;;;;;;;;/m..0000........./s1
InChIKeyUWEKFDBJHAHRDF-RRPROUPOSA-M
MW2767.92 g/mol
LogP20.29
Rot. Bonds21

About potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide

potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide (PubChem CID 161210626) has the molecular formula C126H137BBrCl4F4KN11O21P9 and a molecular weight of 2767.92 g/mol. Its IUPAC name is potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide.

Molecular Properties

Compound Namepotassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide
PubChem CID161210626
Molecular FormulaC126H137BBrCl4F4KN11O21P9
Molecular Weight2767.92 g/mol
Exact Mass2763.52
IUPAC Namepotassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide
SMILESC.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOC(=O)c1nn2c(c1-c1ccc(Cl)cc1C)OC[C@@H](F)C2.CCOC(=O)c1nn2c(c1Br)OC[C@@H](F)C2.CO.Cc1cc(Cl)ccc1-c1c(C(=O)NC2CC2)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1-c1c(C(=O)O)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1B(O)O.NC1CC1.PP(P)P(P)P.[K+].[OH-]
InChIInChI=1S/C21H4.C20H6.C17H17ClFN3O2.C16H16ClFN2O3.C14H12ClFN2O3.C9H10BrFN2O3.C9H21O6P3.C8H19N.C7H8BClO2.C3H7N.CH4O.CH4.K.H2O.H8P6/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2;1-9-6-10(18)2-5-13(9)14-15(16(23)20-12-3-4-12)21-22-7-11(19)8-24-17(14)22;1-3-22-16(21)14-13(12-5-4-10(17)6-9(12)2)15-20(19-14)7-11(18)8-23-15;1-7-4-8(15)2-3-10(7)11-12(14(19)20)17-18-5-9(16)6-21-13(11)18;1-2-15-9(14)7-6(10)8-13(12-7)3-5(11)4-16-8;1-4-7-16(10)13-17(11,8-5-2)15-18(12,14-16)9-6-3;1-6-9(7(2)3)8(4)5;1-5-4-6(9)2-3-7(5)8(10)11;4-3-1-2-3;1-2;;;;1-5(2)6(3)4/h1H,2H3;1-2H3;2,5-6,11-12H,3-4,7-8H2,1H3,(H,20,23);4-6,11H,3,7-8H2,1-2H3;2-4,9H,5-6H2,1H3,(H,19,20);5H,2-4H2,1H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;2-4,10-11H,1H3;3H,1-2,4H2;2H,1H3;1H4;;1H2;1-4H2/q;;;;;;;;;;;;+1;;/p-1/t;;2*11-;9-;5-;;;;;;;;;/m..0000........./s1
InChIKeyUWEKFDBJHAHRDF-RRPROUPOSA-M
XLogP20.29
TPSA426.05 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms178
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002767.92
LogP ≤ 520.29
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide with MolForge

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Frequently Asked Questions

What is the IUPAC name of potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide?
The IUPAC name of potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide (CID 161210626) is potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide.
What is the SMILES notation for potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide?
The canonical SMILES for potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide is C.C#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOC(=O)c1nn2c(c1-c1ccc(Cl)cc1C)OC[C@@H](F)C2.CCOC(=O)c1nn2c(c1Br)OC[C@@H](F)C2.CO.Cc1cc(Cl)ccc1-c1c(C(=O)NC2CC2)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1-c1c(C(=O)O)nn2c1OC[C@@H](F)C2.Cc1cc(Cl)ccc1B(O)O.NC1CC1.PP(P)P(P)P.[K+].[OH-].
What is the InChIKey of potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide?
The InChIKey is UWEKFDBJHAHRDF-RRPROUPOSA-M. The full InChI is InChI=1S/C21H4.C20H6.C17H17ClFN3O2.C16H16ClFN2O3.C14H12ClFN2O3.C9H10BrFN2O3.C9H21O6P3.C8H19N.C7H8BClO2.C3H7N.CH4O.CH4.K.H2O.H8P6/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2;1-9-6-10(18)2-5-13(9)14-15(16(23)20-12-3-4-12)21-22-7-11(19)8-24-17(14)22;1-3-22-16(21)14-13(12-5-4-10(17)6-9(12)2)15-20(19-14)7-11(18)8-23-15;1-7-4-8(15)2-3-10(7)11-12(14(19)20)17-18-5-9(16)6-21-13(11)18;1-2-15-9(14)7-6(10)8-13(12-7)3-5(11)4-16-8;1-4-7-16(10)13-17(11,8-5-2)15-18(12,14-16)9-6-3;1-6-9(7(2)3)8(4)5;1-5-4-6(9)2-3-7(5)8(10)11;4-3-1-2-3;1-2;;;;1-5(2)6(3)4/h1H,2H3;1-2H3;2,5-6,11-12H,3-4,7-8H2,1H3,(H,20,23);4-6,11H,3,7-8H2,1-2H3;2-4,9H,5-6H2,1H3,(H,19,20);5H,2-4H2,1H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;2-4,10-11H,1H3;3H,1-2,4H2;2H,1H3;1H4;;1H2;1-4H2/q;;;;;;;;;;;;+1;;/p-1/t;;2*11-;9-;5-;;;;;;;;;/m..0000........./s1.
What are the key properties of potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide?
potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide has a molecular weight of 2767.92 g/mol, XLogP of 20.29, 21 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;bis(phosphanyl)phosphanyl-bis(phosphanyl)phosphane;(4-chloro-2-methylphenyl)boronic acid;(6S)-3-(4-chloro-2-methylphenyl)-N-cyclopropyl-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxamide;(6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylic acid;cyclopropanamine;ethyl (6S)-3-bromo-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;ethyl (6S)-3-(4-chloro-2-methylphenyl)-6-fluoro-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-2-carboxylate;N-ethyl-N-propan-2-ylpropan-2-amine;henicosa-1,3,5,7,9,11,13,15,17,19-decayne;icosa-2,4,6,8,10,12,14,16,18-nonayne;methane;methanol;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydroxide is sourced from PubChem (CID 161210626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).