[(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate

C158H158ClN29O28 — CID 161247440

About [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate

[(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate (PubChem CID 161247440) has the molecular formula C158H158ClN29O28 and a molecular weight of 2946.63 g/mol. Its IUPAC name is [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate.

Molecular Properties

• Compound Name: [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate
• PubChem CID: 161247440
• Molecular Formula: C158H158ClN29O28
• Molecular Weight: 2946.63 g/mol
• Exact Mass: 2944.15
• IUPAC Name: [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate
• SMILES: C#C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21.C#C[C@@]1(OC(=O)c2ccccc2)[C@H](C)[C@@H](CC)O[C@H]1n1cnc2c(Cl)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CC)O[C@H]2n1cnc2c(N)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CC)O[C@H]2n1cnc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CO)O[C@H]2n1cnc2c(N)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CO)O[C@H]2n1cnc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)ncnc21.C#C[C@]1(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)O[C@H](CC)[C@H]1C
• InChI: InChI=1S/C36H35N5O4.C35H33N5O5.C23H22O5.C21H19ClN4O3.C16H19N5O3.C15H17N5O4.C12H13N5O4/c1-6-28-30-35(7-2,45-34(3,4)44-30)33(43-28)41-23-39-29-31(37-22-38-32(29)41)40-36(24-14-10-8-11-15-24,25-16-12-9-13-17-25)26-18-20-27(42-5)21-19-26;1-5-34-29(44-33(2,3)45-34)27(20-41)43-32(34)40-22-38-28-30(36-21-37-31(28)40)39-35(23-12-8-6-9-13-23,24-14-10-7-11-15-24)25-16-18-26(42-4)19-17-25;1-4-19-16(3)23(5-2,28-21(25)18-14-10-7-11-15-18)22(26-19)27-20(24)17-12-8-6-9-13-17;1-4-15-13(3)21(5-2,29-19(27)14-9-7-6-8-10-14)20(28-15)26-12-25-16-17(22)23-11-24-18(16)26;1-5-9-11-16(6-2,24-15(3,4)23-11)14(22-9)21-8-20-10-12(17)18-7-19-13(10)21;1-4-15-10(23-14(2,3)24-15)8(5-21)22-13(15)20-7-19-9-11(16)17-6-18-12(9)20;1-2-12(20)8(19)6(3-18)21-11(12)17-5-16-7-9(13)14-4-15-10(7)17/h2,8-23,28,30,33H,6H2,1,3-5H3,(H,37,38,40);1,6-19,21-22,27,29,32,41H,20H2,2-4H3,(H,36,37,39);2,6-16,19,22H,4H2,1,3H3;2,6-13,15,20H,4H2,1,3H3;2,7-9,11,14H,5H2,1,3-4H3,(H2,17,18,19);1,6-8,10,13,21H,5H2,2-3H3,(H2,16,17,18);1,4-6,8,11,18-20H,3H2,(H2,13,14,15)/t28-,30-,33-,35-;27-,29-,32-,34-;16-,19-,22?,23-;13-,15-,20-,21-;9-,11-,14-,16-;8-,10-,13-,15-;6-,8-,11-,12-/m1111111/s1
• InChIKey: VAVBAIGRWZOFNV-PPLJVSHXSA-N
• XLogP: 17.30
• TPSA: 700.68 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 57
• Rotatable Bonds: 31
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2946.63
LogP ≤ 5	17.30
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	57

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate?

The IUPAC name of [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate (CID 161247440) is [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate.

What is the SMILES notation for [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate?

The canonical SMILES for [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate is C#C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21.C#C[C@@]1(OC(=O)c2ccccc2)[C@H](C)[C@@H](CC)O[C@H]1n1cnc2c(Cl)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CC)O[C@H]2n1cnc2c(N)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CC)O[C@H]2n1cnc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CO)O[C@H]2n1cnc2c(N)ncnc21.C#C[C@@]12OC(C)(C)O[C@@H]1[C@@H](CO)O[C@H]2n1cnc2c(NC(c3ccccc3)(c3ccccc3)c3ccc(OC)cc3)ncnc21.C#C[C@]1(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)O[C@H](CC)[C@H]1C.

What is the InChIKey of [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate?

The InChIKey is VAVBAIGRWZOFNV-PPLJVSHXSA-N. The full InChI is InChI=1S/C36H35N5O4.C35H33N5O5.C23H22O5.C21H19ClN4O3.C16H19N5O3.C15H17N5O4.C12H13N5O4/c1-6-28-30-35(7-2,45-34(3,4)44-30)33(43-28)41-23-39-29-31(37-22-38-32(29)41)40-36(24-14-10-8-11-15-24,25-16-12-9-13-17-25)26-18-20-27(42-5)21-19-26;1-5-34-29(44-33(2,3)45-34)27(20-41)43-32(34)40-22-38-28-30(36-21-37-31(28)40)39-35(23-12-8-6-9-13-23,24-14-10-7-11-15-24)25-16-18-26(42-4)19-17-25;1-4-19-16(3)23(5-2,28-21(25)18-14-10-7-11-15-18)22(26-19)27-20(24)17-12-8-6-9-13-17;1-4-15-13(3)21(5-2,29-19(27)14-9-7-6-8-10-14)20(28-15)26-12-25-16-17(22)23-11-24-18(16)26;1-5-9-11-16(6-2,24-15(3,4)23-11)14(22-9)21-8-20-10-12(17)18-7-19-13(10)21;1-4-15-10(23-14(2,3)24-15)8(5-21)22-13(15)20-7-19-9-11(16)17-6-18-12(9)20;1-2-12(20)8(19)6(3-18)21-11(12)17-5-16-7-9(13)14-4-15-10(7)17/h2,8-23,28,30,33H,6H2,1,3-5H3,(H,37,38,40);1,6-19,21-22,27,29,32,41H,20H2,2-4H3,(H,36,37,39);2,6-16,19,22H,4H2,1,3H3;2,6-13,15,20H,4H2,1,3H3;2,7-9,11,14H,5H2,1,3-4H3,(H2,17,18,19);1,6-8,10,13,21H,5H2,2-3H3,(H2,16,17,18);1,4-6,8,11,18-20H,3H2,(H2,13,14,15)/t28-,30-,33-,35-;27-,29-,32-,34-;16-,19-,22?,23-;13-,15-,20-,21-;9-,11-,14-,16-;8-,10-,13-,15-;6-,8-,11-,12-/m1111111/s1.

What are the key properties of [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate?

[(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate has a molecular weight of 2946.63 g/mol, XLogP of 17.30, 31 rotatable bonds, 10 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for [(3aR,4R,6R,6aR)-3a-ethynyl-4-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;[(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-6-yl]methanol;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine;9-[(3aR,4R,6R,6aR)-6-ethyl-3a-ethynyl-2,2-dimethyl-6,6a-dihydro-4H-furo[3,4-d][1,3]dioxol-4-yl]purin-6-amine;(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-3-ethynyl-5-(hydroxymethyl)oxolane-3,4-diol;[(3S,4R,5R)-3-benzoyloxy-5-ethyl-3-ethynyl-4-methyloxolan-2-yl] benzoate;[(2R,3S,4R,5R)-2-(6-chloropurin-9-yl)-5-ethyl-3-ethynyl-4-methyloxolan-3-yl] benzoate is sourced from PubChem (CID 161247440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).