bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride

C129H161ClF4N25O23P7 — CID 161384582

IUPACbis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride
SMILESC#CC#CC#CC#CC#CC#CC#C.CC(C)(C)OC(=O)N1C[C@@H](N)C[C@H](F)C1.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@H]3C[C@H](F)CN(C(=O)OC(C)(C)C)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)O)cn2)c1.Cl.P.PPP
InChIInChI=1S/C27H31FN6O5.2C22H23FN6O3.C17H14N4O4.C14H2.C10H19FN2O2.C9H21O6P3.C8H19N.ClH.H5P3.H3P/c1-5-37-22-7-6-8-30-25(22)38-21-9-17(11-29-14-21)23-31-12-18(13-32-23)24(35)33-20-10-19(28)15-34(16-20)26(36)39-27(2,3)4;2*1-2-31-19-4-3-5-26-22(19)32-18-6-14(8-24-13-18)20-27-9-15(10-28-20)21(30)29-17-7-16(23)11-25-12-17;1-2-24-14-4-3-5-19-16(14)25-13-6-11(7-18-10-13)15-20-8-12(9-21-15)17(22)23;1-3-5-7-9-11-13-14-12-10-8-6-4-2;1-10(2,3)15-9(14)13-5-7(11)4-8(12)6-13;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;;1-3-2;/h6-9,11-14,19-20H,5,10,15-16H2,1-4H3,(H,33,35);2*3-6,8-10,13,16-17,25H,2,7,11-12H2,1H3,(H,29,30);3-10H,2H2,1H3,(H,22,23);1-2H;7-8H,4-6,12H2,1-3H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;1H;3H,1-2H2;1H3/t19-,20-;2*16-,17-;;;7-,8-;;;;;/m000..0...../s1
InChIKeyCAZMBJFYDXBPJK-GDOYRBJYSA-N
MW2758.12 g/mol
LogP22.41
Rot. Bonds36

About bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride

bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride (PubChem CID 161384582) has the molecular formula C129H161ClF4N25O23P7 and a molecular weight of 2758.12 g/mol. Its IUPAC name is bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride.

Molecular Properties

Compound Namebis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride
PubChem CID161384582
Molecular FormulaC129H161ClF4N25O23P7
Molecular Weight2758.12 g/mol
Exact Mass2756.00
IUPAC Namebis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride
SMILESC#CC#CC#CC#CC#CC#CC#C.CC(C)(C)OC(=O)N1C[C@@H](N)C[C@H](F)C1.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@H]3C[C@H](F)CN(C(=O)OC(C)(C)C)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)O)cn2)c1.Cl.P.PPP
InChIInChI=1S/C27H31FN6O5.2C22H23FN6O3.C17H14N4O4.C14H2.C10H19FN2O2.C9H21O6P3.C8H19N.ClH.H5P3.H3P/c1-5-37-22-7-6-8-30-25(22)38-21-9-17(11-29-14-21)23-31-12-18(13-32-23)24(35)33-20-10-19(28)15-34(16-20)26(36)39-27(2,3)4;2*1-2-31-19-4-3-5-26-22(19)32-18-6-14(8-24-13-18)20-27-9-15(10-28-20)21(30)29-17-7-16(23)11-25-12-17;1-2-24-14-4-3-5-19-16(14)25-13-6-11(7-18-10-13)15-20-8-12(9-21-15)17(22)23;1-3-5-7-9-11-13-14-12-10-8-6-4-2;1-10(2,3)15-9(14)13-5-7(11)4-8(12)6-13;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;;1-3-2;/h6-9,11-14,19-20H,5,10,15-16H2,1-4H3,(H,33,35);2*3-6,8-10,13,16-17,25H,2,7,11-12H2,1H3,(H,29,30);3-10H,2H2,1H3,(H,22,23);1-2H;7-8H,4-6,12H2,1-3H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;1H;3H,1-2H2;1H3/t19-,20-;2*16-,17-;;;7-,8-;;;;;/m000..0...../s1
InChIKeyCAZMBJFYDXBPJK-GDOYRBJYSA-N
XLogP22.41
TPSA595.98 Ų
H-Bond Donors7
H-Bond Acceptors42
Rotatable Bonds36
Heavy Atoms189
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002758.12
LogP ≤ 522.41
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

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

Analyze bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl (3S,4S)-3-amino-4-[[4-(6-ethoxy-2-fluoro-3-methoxybenzoyl)benzoyl]amino]pyrrolidine-1-carboxylate;tert-butyl (3S,4S)-3,4-diaminopyrrolidine-1-carboxylate;4-(6-ethoxy-2-fluoro-3-methoxybenzoyl)benzoic acid;N-[(3S,4S)-4-[[4-(2-fluoro-6-hydroxy-3-methoxybenzoyl)benzoyl]amino]pyrrolidin-3-yl]pyridine-4-carboxamide;pyridine-4-carboxylic acid
CID 160933360
tert-butyl 3-[1-(5-fluoro-3-pyridinyl)ethylamino]azetidine-1-carboxylate
CID 103788166
tert-butyl 4-[3-[3-[[3-[(4-aminocyclohexyl)carbamoyl]-5-fluoro-2-pyridinyl]oxy]-4-phenylphenyl]propyl]piperazine-1-carboxylate
CID 141255328
tert-butyl (3S,5S)-3-[[4-[2-(4-amino-2-methylnaphthalen-1-yl)oxy-3-pyridinyl]pyrimidin-2-yl]amino]-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-fluoro-5-[[4-[2-[2-methyl-4-[(1-methylcyclopropyl)sulfonylamino]naphthalen-1-yl]oxy-3-pyridinyl]pyrimidin-2-yl]amino]piperidine-1-carboxylate;N-[4-[[3-[2-[[(3S,5S)-5-fluoropiperidin-3-yl]amino]pyrimidin-4-yl]-2-pyridinyl]oxy]-3-methylnaphthalen-1-yl]-1-methylcyclopropane-1-sulfonamide;1-methylcyclopropane-1-sulfonyl chloride
CID 164984381
tert-butyl 4-[2-(2-ethoxy-6-fluorophenoxy)-3-pyridinyl]piperidine-1-carboxylate
CID 143825057
tert-butyl 3-[[N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]-N'-methylcarbamimidoyl]amino]azetidine-1-carboxylate;hydroiodide
CID 109466977
tert-butyl 3-[[(1S)-1-pyridin-4-ylethyl]amino]azetidine-1-carboxylate
CID 81405804
tert-butyl (3aR,6aS)-5-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate
CID 162501997
tert-butyl 3-(pyridine-4-carbonylamino)pyrrolidine-1-carboxylate
CID 66630666
tert-butyl (3R,4R)-3-[[4-(6-ethoxy-2-fluoro-3-methoxybenzoyl)benzoyl]amino]-4-(pyridine-4-carbonylamino)pyrrolidine-1-carboxylate;N-[(3R,4R)-4-[[4-[(2-fluoro-6-hydroxy-3-methoxyphenyl)-hydroxymethyl]benzoyl]amino]pyrrolidin-3-yl]pyridine-4-carboxamide
CID 162100106
5-[[4-methoxy-3-(3-methoxypropoxy)benzoyl]amino]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
CID 70954305
tert-butyl 3-[[6-(cyclopropylcarbamoyl)-5-fluoro-3-pyridinyl]oxymethyl]azetidine-1-carboxylate
CID 170316001

Frequently Asked Questions

What is the IUPAC name of bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride?
The IUPAC name of bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride (CID 161384582) is bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride.
What is the SMILES notation for bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride?
The canonical SMILES for bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride is C#CC#CC#CC#CC#CC#CC#C.CC(C)(C)OC(=O)N1C[C@@H](N)C[C@H](F)C1.CCCP1(=O)OP(=O)(CCC)OP(=O)(CCC)O1.CCN(C(C)C)C(C)C.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@@H]3CNC[C@@H](F)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)N[C@H]3C[C@H](F)CN(C(=O)OC(C)(C)C)C3)cn2)c1.CCOc1cccnc1Oc1cncc(-c2ncc(C(=O)O)cn2)c1.Cl.P.PPP.
What is the InChIKey of bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride?
The InChIKey is CAZMBJFYDXBPJK-GDOYRBJYSA-N. The full InChI is InChI=1S/C27H31FN6O5.2C22H23FN6O3.C17H14N4O4.C14H2.C10H19FN2O2.C9H21O6P3.C8H19N.ClH.H5P3.H3P/c1-5-37-22-7-6-8-30-25(22)38-21-9-17(11-29-14-21)23-31-12-18(13-32-23)24(35)33-20-10-19(28)15-34(16-20)26(36)39-27(2,3)4;2*1-2-31-19-4-3-5-26-22(19)32-18-6-14(8-24-13-18)20-27-9-15(10-28-20)21(30)29-17-7-16(23)11-25-12-17;1-2-24-14-4-3-5-19-16(14)25-13-6-11(7-18-10-13)15-20-8-12(9-21-15)17(22)23;1-3-5-7-9-11-13-14-12-10-8-6-4-2;1-10(2,3)15-9(14)13-5-7(11)4-8(12)6-13;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;;1-3-2;/h6-9,11-14,19-20H,5,10,15-16H2,1-4H3,(H,33,35);2*3-6,8-10,13,16-17,25H,2,7,11-12H2,1H3,(H,29,30);3-10H,2H2,1H3,(H,22,23);1-2H;7-8H,4-6,12H2,1-3H3;4-9H2,1-3H3;7-8H,6H2,1-5H3;1H;3H,1-2H2;1H3/t19-,20-;2*16-,17-;;;7-,8-;;;;;/m000..0...../s1.
What are the key properties of bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride?
bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride has a molecular weight of 2758.12 g/mol, XLogP of 22.41, 36 rotatable bonds, 7 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for bis(phosphanyl)phosphane;tert-butyl (3S,5S)-3-amino-5-fluoropiperidine-1-carboxylate;tert-butyl (3S,5S)-3-[[2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carbonyl]amino]-5-fluoropiperidine-1-carboxylate;bis(2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S,5S)-5-fluoropiperidin-3-yl]pyrimidine-5-carboxamide);2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]pyrimidine-5-carboxylic acid;N-ethyl-N-propan-2-ylpropan-2-amine;phosphane;tetradeca-1,3,5,7,9,11,13-heptayne;2,4,6-tripropyl-1,3,5,2λ5,4λ5,6λ5-trioxatriphosphinane 2,4,6-trioxide;hydrochloride is sourced from PubChem (CID 161384582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).