2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate

C136H179BrN38O28 — CID 157065129

About 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate

2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate (PubChem CID 157065129) has the molecular formula C136H179BrN38O28 and a molecular weight of 2874.07 g/mol. Its IUPAC name is 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate.

Molecular Properties

• Compound Name: 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
• PubChem CID: 157065129
• Molecular Formula: C136H179BrN38O28
• Molecular Weight: 2874.07 g/mol
• Exact Mass: 2871.29
• IUPAC Name: 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
• SMILES: CC(C)(C)OC(=O)N1CCC(C(C(=O)O)n2ncc3c2nc(N)n2nc(-c4ccco4)nc32)CC1.COC(=O)C(Br)C1CCN(C(=O)OC(C)(C)C)CC1.COC(=O)C(C1CCN(C(=O)OC(C)(C)C)CC1)n1ncc2c1nc(N)n1nc(-c3ccco3)nc21.COC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1.COCCOc1ccc(N2CCN(C(=O)C(C3CCN(C(=O)OC(C)(C)C)CC3)n3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1.COCCOc1ccc(N2CCN(C(=O)C(C3CCNCC3)n3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1
• InChI: InChI=1S/C35H44N10O6.C30H36N10O4.C23H28N8O5.C22H26N8O5.C13H22BrNO4.C13H23NO4/c1-35(2,3)51-34(47)43-13-11-23(12-14-43)28(32(46)42-17-15-41(16-18-42)24-7-9-25(10-8-24)49-21-20-48-4)44-31-26(22-37-44)30-38-29(27-6-5-19-50-27)40-45(30)33(36)39-31;1-42-17-18-43-22-6-4-21(5-7-22)37-12-14-38(15-13-37)29(41)25(20-8-10-32-11-9-20)39-28-23(19-33-39)27-34-26(24-3-2-16-44-24)36-40(27)30(31)35-28;1-23(2,3)36-22(33)29-9-7-13(8-10-29)16(20(32)34-4)30-19-14(12-25-30)18-26-17(15-6-5-11-35-15)28-31(18)21(24)27-19;1-22(2,3)35-21(33)28-8-6-12(7-9-28)15(19(31)32)29-18-13(11-24-29)17-25-16(14-5-4-10-34-14)27-30(17)20(23)26-18;1-13(2,3)19-12(17)15-7-5-9(6-8-15)10(14)11(16)18-4;1-13(2,3)18-12(16)14-7-5-10(6-8-14)9-11(15)17-4/h5-10,19,22-23,28H,11-18,20-21H2,1-4H3,(H2,36,39);2-7,16,19-20,25,32H,8-15,17-18H2,1H3,(H2,31,35);5-6,11-13,16H,7-10H2,1-4H3,(H2,24,27);4-5,10-12,15H,6-9H2,1-3H3,(H2,23,26)(H,31,32);9-10H,5-8H2,1-4H3;10H,5-9H2,1-4H3
• InChIKey: ABUCNTWWXZJHQQ-UHFFFAOYSA-N
• XLogP: 16.14
• TPSA: 760.19 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 58
• Rotatable Bonds: 30
• Heavy Atoms: 203
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2874.07
LogP ≤ 5	16.14
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	58

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate?

The IUPAC name of 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate (CID 157065129) is 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate.

What is the SMILES notation for 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate?

The canonical SMILES for 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC(C(C(=O)O)n2ncc3c2nc(N)n2nc(-c4ccco4)nc32)CC1.COC(=O)C(Br)C1CCN(C(=O)OC(C)(C)C)CC1.COC(=O)C(C1CCN(C(=O)OC(C)(C)C)CC1)n1ncc2c1nc(N)n1nc(-c3ccco3)nc21.COC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1.COCCOc1ccc(N2CCN(C(=O)C(C3CCN(C(=O)OC(C)(C)C)CC3)n3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1.COCCOc1ccc(N2CCN(C(=O)C(C3CCNCC3)n3ncc4c3nc(N)n3nc(-c5ccco5)nc43)CC2)cc1.

What is the InChIKey of 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate?

The InChIKey is ABUCNTWWXZJHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H44N10O6.C30H36N10O4.C23H28N8O5.C22H26N8O5.C13H22BrNO4.C13H23NO4/c1-35(2,3)51-34(47)43-13-11-23(12-14-43)28(32(46)42-17-15-41(16-18-42)24-7-9-25(10-8-24)49-21-20-48-4)44-31-26(22-37-44)30-38-29(27-6-5-19-50-27)40-45(30)33(36)39-31;1-42-17-18-43-22-6-4-21(5-7-22)37-12-14-38(15-13-37)29(41)25(20-8-10-32-11-9-20)39-28-23(19-33-39)27-34-26(24-3-2-16-44-24)36-40(27)30(31)35-28;1-23(2,3)36-22(33)29-9-7-13(8-10-29)16(20(32)34-4)30-19-14(12-25-30)18-26-17(15-6-5-11-35-15)28-31(18)21(24)27-19;1-22(2,3)35-21(33)28-8-6-12(7-9-28)15(19(31)32)29-18-13(11-24-29)17-25-16(14-5-4-10-34-14)27-30(17)20(23)26-18;1-13(2,3)19-12(17)15-7-5-9(6-8-15)10(14)11(16)18-4;1-13(2,3)18-12(16)14-7-5-10(6-8-14)9-11(15)17-4/h5-10,19,22-23,28H,11-18,20-21H2,1-4H3,(H2,36,39);2-7,16,19-20,25,32H,8-15,17-18H2,1H3,(H2,31,35);5-6,11-13,16H,7-10H2,1-4H3,(H2,24,27);4-5,10-12,15H,6-9H2,1-3H3,(H2,23,26)(H,31,32);9-10H,5-8H2,1-4H3;10H,5-9H2,1-4H3.

What are the key properties of 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate?

2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate has a molecular weight of 2874.07 g/mol, XLogP of 16.14, 30 rotatable bonds, 6 hydrogen bond donors, and 58 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-1-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-piperidin-4-ylethanone;2-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-[1-[7-amino-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-10-yl]-2-methoxy-2-oxoethyl]piperidine-1-carboxylate;tert-butyl 4-(1-bromo-2-methoxy-2-oxoethyl)piperidine-1-carboxylate;tert-butyl 4-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate is sourced from PubChem (CID 157065129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).