tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate

C158H180F5N43O24S6 — CID 162239127

About tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate

tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate (PubChem CID 162239127) has the molecular formula C158H180F5N43O24S6 and a molecular weight of 3352.85 g/mol. Its IUPAC name is tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate.

Molecular Properties

• Compound Name: tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate
• PubChem CID: 162239127
• Molecular Formula: C158H180F5N43O24S6
• Molecular Weight: 3352.85 g/mol
• Exact Mass: 3350.24
• IUPAC Name: tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate
• SMILES: CC(C)(C)OC(=O)N(CCc1nc2c(NCc3ncccc3F)ncnc2s1)CCc1nc2cc(CN=[N+]=[N-])ccc2n1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(CCc1nc2c(NCc3ncccc3F)ncnc2s1)CCc1nc2cc(COS(C)(=O)=O)ccc2n1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(CCc1nc2ccc(CO)cc2[nH]1)CCc1nc2c(NCc3ncccc3F)ncnc2s1.COC(=O)c1ccc2c(c1)nc(CCN(CCc1nc3c(NCc4ncccc4F)ncnc3s1)C(=O)OC(C)(C)C)n2C(=O)OC(C)(C)C.COC(=O)c1ccc2c(c1)nc(CCNCCc1nc3c(NCc4ncccc4F)ncnc3s1)n2C(=O)OC(C)(C)C
• InChI: InChI=1S/C34H41FN8O7S2.C34H39FN8O6S.C33H38FN11O4S.C29H31FN8O4S.C28H31FN8O3S/c1-33(2,3)49-31(44)42(16-13-27-41-28-29(38-20-39-30(28)51-27)37-18-24-22(35)9-8-14-36-24)15-12-26-40-23-17-21(19-48-52(7,46)47)10-11-25(23)43(26)32(45)50-34(4,5)6;1-33(2,3)48-31(45)42(16-13-26-41-27-28(38-19-39-29(27)50-26)37-18-23-21(35)9-8-14-36-23)15-12-25-40-22-17-20(30(44)47-7)10-11-24(22)43(25)32(46)49-34(4,5)6;1-32(2,3)48-30(46)44(15-12-26-42-27-28(38-19-39-29(27)50-26)37-18-23-21(34)8-7-13-36-23)14-11-25-41-22-16-20(17-40-43-35)9-10-24(22)45(25)31(47)49-33(4,5)6;1-29(2,3)42-28(40)38-21-8-7-17(27(39)41-4)14-19(21)36-22(38)9-12-31-13-10-23-37-24-25(34-16-35-26(24)43-23)33-15-20-18(30)6-5-11-32-20;1-28(2,3)40-27(39)37(11-8-22-34-19-7-6-17(15-38)13-20(19)35-22)12-9-23-36-24-25(32-16-33-26(24)41-23)31-14-21-18(29)5-4-10-30-21/h8-11,14,17,20H,12-13,15-16,18-19H2,1-7H3,(H,37,38,39);8-11,14,17,19H,12-13,15-16,18H2,1-7H3,(H,37,38,39);7-10,13,16,19H,11-12,14-15,17-18H2,1-6H3,(H,37,38,39);5-8,11,14,16,31H,9-10,12-13,15H2,1-4H3,(H,33,34,35);4-7,10,13,16,38H,8-9,11-12,14-15H2,1-3H3,(H,34,35)(H,31,32,33)
• InChIKey: ZWLSGLCJOVUGLD-UHFFFAOYSA-N
• XLogP: 28.39
• TPSA: 818.26 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 65
• Rotatable Bonds: 53
• Heavy Atoms: 236
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3352.85
LogP ≤ 5	28.39
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	65

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate?

The IUPAC name of tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate (CID 162239127) is tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate.

What is the SMILES notation for tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate?

The canonical SMILES for tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate is CC(C)(C)OC(=O)N(CCc1nc2c(NCc3ncccc3F)ncnc2s1)CCc1nc2cc(CN=[N+]=[N-])ccc2n1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(CCc1nc2c(NCc3ncccc3F)ncnc2s1)CCc1nc2cc(COS(C)(=O)=O)ccc2n1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N(CCc1nc2ccc(CO)cc2[nH]1)CCc1nc2c(NCc3ncccc3F)ncnc2s1.COC(=O)c1ccc2c(c1)nc(CCN(CCc1nc3c(NCc4ncccc4F)ncnc3s1)C(=O)OC(C)(C)C)n2C(=O)OC(C)(C)C.COC(=O)c1ccc2c(c1)nc(CCNCCc1nc3c(NCc4ncccc4F)ncnc3s1)n2C(=O)OC(C)(C)C.

What is the InChIKey of tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate?

The InChIKey is ZWLSGLCJOVUGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H41FN8O7S2.C34H39FN8O6S.C33H38FN11O4S.C29H31FN8O4S.C28H31FN8O3S/c1-33(2,3)49-31(44)42(16-13-27-41-28-29(38-20-39-30(28)51-27)37-18-24-22(35)9-8-14-36-24)15-12-26-40-23-17-21(19-48-52(7,46)47)10-11-25(23)43(26)32(45)50-34(4,5)6;1-33(2,3)48-31(45)42(16-13-26-41-27-28(38-19-39-29(27)50-26)37-18-23-21(35)9-8-14-36-23)15-12-25-40-22-17-20(30(44)47-7)10-11-24(22)43(25)32(46)49-34(4,5)6;1-32(2,3)48-30(46)44(15-12-26-42-27-28(38-19-39-29(27)50-26)37-18-23-21(34)8-7-13-36-23)14-11-25-41-22-16-20(17-40-43-35)9-10-24(22)45(25)31(47)49-33(4,5)6;1-29(2,3)42-28(40)38-21-8-7-17(27(39)41-4)14-19(21)36-22(38)9-12-31-13-10-23-37-24-25(34-16-35-26(24)43-23)33-15-20-18(30)6-5-11-32-20;1-28(2,3)40-27(39)37(11-8-22-34-19-7-6-17(15-38)13-20(19)35-22)12-9-23-36-24-25(32-16-33-26(24)41-23)31-14-21-18(29)5-4-10-30-21/h8-11,14,17,20H,12-13,15-16,18-19H2,1-7H3,(H,37,38,39);8-11,14,17,19H,12-13,15-16,18H2,1-7H3,(H,37,38,39);7-10,13,16,19H,11-12,14-15,17-18H2,1-6H3,(H,37,38,39);5-8,11,14,16,31H,9-10,12-13,15H2,1-4H3,(H,33,34,35);4-7,10,13,16,38H,8-9,11-12,14-15H2,1-3H3,(H,34,35)(H,31,32,33).

What are the key properties of tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate?

tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate has a molecular weight of 3352.85 g/mol, XLogP of 28.39, 53 rotatable bonds, 8 hydrogen bond donors, and 65 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 5-(azidomethyl)-2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1-carboxylate;tert-butyl N-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl]-N-[2-[6-(hydroxymethyl)-1H-benzimidazol-2-yl]ethyl]carbamate;tert-butyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-5-(methylsulfonyloxymethyl)benzimidazole-1-carboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethylamino]ethyl]benzimidazole-1,5-dicarboxylate;1-O-tert-butyl 5-O-methyl 2-[2-[2-[7-[(3-fluoro-2-pyridinyl)methylamino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]benzimidazole-1,5-dicarboxylate is sourced from PubChem (CID 162239127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).