tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde

C123H176BBr2Cl3F3N29O22 — CID 158452937

About tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde

tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde (PubChem CID 158452937) has the molecular formula C123H176BBr2Cl3F3N29O22 and a molecular weight of 2746.91 g/mol. Its IUPAC name is tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde.

Molecular Properties

• Compound Name: tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde
• PubChem CID: 158452937
• Molecular Formula: C123H176BBr2Cl3F3N29O22
• Molecular Weight: 2746.91 g/mol
• Exact Mass: 2742.10
• IUPAC Name: tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde
• SMILES: C1CCOC1.CCCc1nccc(-c2[nH]nc3nc(N4CCC5(CC4)CO[C@@H](C)[C@H]5N)c(C)nc23)c1Cl.CCN(C(=O)OC(C)(C)C)c1nccc(-c2nn(C(=O)OC(C)(C)C)c3nc(N4CCC5(CC4)CO[C@@H](C)[C@H]5NC(=O)OC(C)(C)C)c(C)nc23)c1Cl.CCN(C(=O)OC(C)(C)C)c1nccc(B(O)O)c1Cl.Cc1nc2c(Br)[nH]nc2nc1N1CCC2(CC1)CO[C@@H](C)[C@H]2NC(=O)OC(C)(C)C.Cc1nc2c(Br)nn(C(=O)OC(C)(C)C)c2nc1N1CCC2(CC1)CO[C@@H](C)[C@H]2NC(=O)OC(C)(C)C.O=CC(F)(F)F
• InChI: InChI=1S/C37H53ClN8O7.C25H37BrN6O5.C23H30ClN7O.C20H29BrN6O3.C12H18BClN2O4.C4H8O.C2HF3O/c1-13-45(32(48)52-35(7,8)9)29-24(38)23(14-17-39-29)25-26-30(46(43-25)33(49)53-36(10,11)12)42-28(21(2)40-26)44-18-15-37(16-19-44)20-50-22(3)27(37)41-31(47)51-34(4,5)6;1-14-19(29-20-16(27-14)18(26)30-32(20)22(34)37-24(6,7)8)31-11-9-25(10-12-31)13-35-15(2)17(25)28-21(33)36-23(3,4)5;1-4-5-16-17(24)15(6-9-26-16)18-19-21(30-29-18)28-22(13(2)27-19)31-10-7-23(8-11-31)12-32-14(3)20(23)25;1-11-17(24-16-13(22-11)15(21)25-26-16)27-8-6-20(7-9-27)10-29-12(2)14(20)23-18(28)30-19(3,4)5;1-5-16(11(17)20-12(2,3)4)10-9(14)8(13(18)19)6-7-15-10;1-2-4-5-3-1;3-2(4,5)1-6/h14,17,22,27H,13,15-16,18-20H2,1-12H3,(H,41,47);15,17H,9-13H2,1-8H3,(H,28,33);6,9,14,20H,4-5,7-8,10-12,25H2,1-3H3,(H,28,29,30);12,14H,6-10H2,1-5H3,(H,23,28)(H,24,25,26);6-7,18-19H,5H2,1-4H3;1-4H2;1H/t22-,27+;15-,17+;14-,20+;12-,14+;;;/m0000.../s1
• InChIKey: HEFJRZNDPIUKSW-LRODGKIISA-N
• XLogP: 21.58
• TPSA: 604.12 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 44
• Rotatable Bonds: 16
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2746.91
LogP ≤ 5	21.58
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	44

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'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde?

The IUPAC name of tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde (CID 158452937) is tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde.

What is the SMILES notation for tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde?

The canonical SMILES for tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde is C1CCOC1.CCCc1nccc(-c2[nH]nc3nc(N4CCC5(CC4)CO[C@@H](C)[C@H]5N)c(C)nc23)c1Cl.CCN(C(=O)OC(C)(C)C)c1nccc(-c2nn(C(=O)OC(C)(C)C)c3nc(N4CCC5(CC4)CO[C@@H](C)[C@H]5NC(=O)OC(C)(C)C)c(C)nc23)c1Cl.CCN(C(=O)OC(C)(C)C)c1nccc(B(O)O)c1Cl.Cc1nc2c(Br)[nH]nc2nc1N1CCC2(CC1)CO[C@@H](C)[C@H]2NC(=O)OC(C)(C)C.Cc1nc2c(Br)nn(C(=O)OC(C)(C)C)c2nc1N1CCC2(CC1)CO[C@@H](C)[C@H]2NC(=O)OC(C)(C)C.O=CC(F)(F)F.

What is the InChIKey of tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde?

The InChIKey is HEFJRZNDPIUKSW-LRODGKIISA-N. The full InChI is InChI=1S/C37H53ClN8O7.C25H37BrN6O5.C23H30ClN7O.C20H29BrN6O3.C12H18BClN2O4.C4H8O.C2HF3O/c1-13-45(32(48)52-35(7,8)9)29-24(38)23(14-17-39-29)25-26-30(46(43-25)33(49)53-36(10,11)12)42-28(21(2)40-26)44-18-15-37(16-19-44)20-50-22(3)27(37)41-31(47)51-34(4,5)6;1-14-19(29-20-16(27-14)18(26)30-32(20)22(34)37-24(6,7)8)31-11-9-25(10-12-31)13-35-15(2)17(25)28-21(33)36-23(3,4)5;1-4-5-16-17(24)15(6-9-26-16)18-19-21(30-29-18)28-22(13(2)27-19)31-10-7-23(8-11-31)12-32-14(3)20(23)25;1-11-17(24-16-13(22-11)15(21)25-26-16)27-8-6-20(7-9-27)10-29-12(2)14(20)23-18(28)30-19(3,4)5;1-5-16(11(17)20-12(2,3)4)10-9(14)8(13(18)19)6-7-15-10;1-2-4-5-3-1;3-2(4,5)1-6/h14,17,22,27H,13,15-16,18-20H2,1-12H3,(H,41,47);15,17H,9-13H2,1-8H3,(H,28,33);6,9,14,20H,4-5,7-8,10-12,25H2,1-3H3,(H,28,29,30);12,14H,6-10H2,1-5H3,(H,23,28)(H,24,25,26);6-7,18-19H,5H2,1-4H3;1-4H2;1H/t22-,27+;15-,17+;14-,20+;12-,14+;;;/m0000.../s1.

What are the key properties of tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde?

tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde has a molecular weight of 2746.91 g/mol, XLogP of 21.58, 16 rotatable bonds, 8 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 3-bromo-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;tert-butyl N-[(3S,4S)-8-(3-bromo-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl)-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamate;tert-butyl 3-[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]-5-methyl-6-[(3S,4S)-3-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxa-8-azaspiro[4.5]decan-8-yl]pyrazolo[3,4-b]pyrazine-1-carboxylate;[3-chloro-2-[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-pyridinyl]boronic acid;(3S,4S)-8-[3-(3-chloro-2-propyl-4-pyridinyl)-5-methyl-2H-pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-amine;oxolane;2,2,2-trifluoroacetaldehyde is sourced from PubChem (CID 158452937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).