propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate

C94H138ClN14O42P5 — CID 157263555

About propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate

propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate (PubChem CID 157263555) has the molecular formula C94H138ClN14O42P5 and a molecular weight of 2326.52 g/mol. Its IUPAC name is propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate.

Molecular Properties

• Compound Name: propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate
• PubChem CID: 157263555
• Molecular Formula: C94H138ClN14O42P5
• Molecular Weight: 2326.52 g/mol
• Exact Mass: 2324.75
• IUPAC Name: propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate
• SMILES: C#C[C@]1(C)[C@@H]2O[P@@](=O)(OCCCC(=O)OC(C)C)OC[C@H]2O[C@H]1N1C=CC(=O)CC1=O.CC(C)OC(=O)CCCO[P@]1(=O)OC[C@H]2O[C@@H](N3C=CC(=O)CC3=O)[C@](C)(Cl)[C@@H]2O1.CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@@H]2CO[P@](=O)(OCCCC(=O)OC(C)C)O[C@H]2[C@@]1(C)N.Cc1ccn([C@@H]2O[C@@H]3CO[P@@](=O)(OCCCC(=O)OC(C)C)O[C@H]3[C@@]2(C)N)c(=O)n1.Cc1ccn([C@@H]2O[C@@H]3CO[P@](=O)(OCCCC(=O)OC(C)C)O[C@H]3[C@@]2(C)N)c(=O)n1
• InChI: InChI=1S/C20H31N6O8P.C20H26NO9P.C18H25ClNO9P.2C18H28N3O8P/c1-5-29-17-14-16(24-19(21)25-17)26(10-23-14)18-20(4,22)15-12(33-18)9-31-35(28,34-15)30-8-6-7-13(27)32-11(2)3;1-5-20(4)18-15(29-19(20)21-9-8-14(22)11-16(21)23)12-27-31(25,30-18)26-10-6-7-17(24)28-13(2)3;1-11(2)27-15(23)5-4-8-25-30(24)26-10-13-16(29-30)18(3,19)17(28-13)20-7-6-12(21)9-14(20)22;2*1-11(2)27-14(22)6-5-9-25-30(24)26-10-13-15(29-30)18(4,19)16(28-13)21-8-7-12(3)20-17(21)23/h10-12,15,18H,5-9,22H2,1-4H3,(H2,21,24,25);1,8-9,13,15,18-19H,6-7,10-12H2,2-4H3;6-7,11,13,16-17H,4-5,8-10H2,1-3H3;2*7-8,11,13,15-16H,5-6,9-10,19H2,1-4H3/t12-,15-,18-,20-,35+;15-,18-,19-,20-,31+;13-,16-,17-,18-,30-;13-,15-,16-,18-,30+;13-,15-,16-,18-,30-/m11111/s1
• InChIKey: AXSWLDZZQUAQCS-QKHUJUSCSA-N
• XLogP: 8.80
• TPSA: 702.90 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 54
• Rotatable Bonds: 37
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2326.52
LogP ≤ 5	8.80
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate?

The IUPAC name of propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate (CID 157263555) is propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate.

What is the SMILES notation for propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate?

The canonical SMILES for propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate is C#C[C@]1(C)[C@@H]2O[P@@](=O)(OCCCC(=O)OC(C)C)OC[C@H]2O[C@H]1N1C=CC(=O)CC1=O.CC(C)OC(=O)CCCO[P@]1(=O)OC[C@H]2O[C@@H](N3C=CC(=O)CC3=O)[C@](C)(Cl)[C@@H]2O1.CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@@H]2CO[P@](=O)(OCCCC(=O)OC(C)C)O[C@H]2[C@@]1(C)N.Cc1ccn([C@@H]2O[C@@H]3CO[P@@](=O)(OCCCC(=O)OC(C)C)O[C@H]3[C@@]2(C)N)c(=O)n1.Cc1ccn([C@@H]2O[C@@H]3CO[P@](=O)(OCCCC(=O)OC(C)C)O[C@H]3[C@@]2(C)N)c(=O)n1.

What is the InChIKey of propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate?

The InChIKey is AXSWLDZZQUAQCS-QKHUJUSCSA-N. The full InChI is InChI=1S/C20H31N6O8P.C20H26NO9P.C18H25ClNO9P.2C18H28N3O8P/c1-5-29-17-14-16(24-19(21)25-17)26(10-23-14)18-20(4,22)15-12(33-18)9-31-35(28,34-15)30-8-6-7-13(27)32-11(2)3;1-5-20(4)18-15(29-19(20)21-9-8-14(22)11-16(21)23)12-27-31(25,30-18)26-10-6-7-17(24)28-13(2)3;1-11(2)27-15(23)5-4-8-25-30(24)26-10-13-16(29-30)18(3,19)17(28-13)20-7-6-12(21)9-14(20)22;2*1-11(2)27-14(22)6-5-9-25-30(24)26-10-13-15(29-30)18(4,19)16(28-13)21-8-7-12(3)20-17(21)23/h10-12,15,18H,5-9,22H2,1-4H3,(H2,21,24,25);1,8-9,13,15,18-19H,6-7,10-12H2,2-4H3;6-7,11,13,16-17H,4-5,8-10H2,1-3H3;2*7-8,11,13,15-16H,5-6,9-10,19H2,1-4H3/t12-,15-,18-,20-,35+;15-,18-,19-,20-,31+;13-,16-,17-,18-,30-;13-,15-,16-,18-,30+;13-,15-,16-,18-,30-/m11111/s1.

What are the key properties of propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate?

propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate has a molecular weight of 2326.52 g/mol, XLogP of 8.80, 37 rotatable bonds, 4 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-6-(2-amino-6-ethoxypurin-9-yl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-7-amino-7-methyl-6-(4-methyl-2-oxopyrimidin-1-yl)-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2R,4aR,6R,7R,7aR)-7-chloro-6-(2,4-dioxo-1-pyridinyl)-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate;propan-2-yl 4-[[(2S,4aR,6R,7R,7aS)-6-(2,4-dioxo-1-pyridinyl)-7-ethynyl-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-2-yl]oxy]butanoate is sourced from PubChem (CID 157263555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).