2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid

C157H192N8O34S6 — CID 158511911

About 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid

2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid (PubChem CID 158511911) has the molecular formula C157H192N8O34S6 and a molecular weight of 2927.69 g/mol. Its IUPAC name is 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid.

Molecular Properties

• Compound Name: 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid
• PubChem CID: 158511911
• Molecular Formula: C157H192N8O34S6
• Molecular Weight: 2927.69 g/mol
• Exact Mass: 2925.19
• IUPAC Name: 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid
• SMILES: COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@@]3(C)OCC[C@@H]23)Cc2ccc(N3CC[C@H](Oc4cc5ccccc5cc4C(=O)Nc4sc5c(c4C(=O)O)CC(C)(C)CC5)C3)cc2)cc1.COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@@]3(C)OCC[C@@H]23)Cc2ccc(NCc3cc(N4CCCC4=O)ccc3-c3sc4c(c3C(=O)O)CC(C)(C)CC4)cc2)cc1.COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@H]3OCC[C@H]32)Cc2ccc(NCc3ccccc3C(=O)Cc3sc4c(c3C(=O)O)CC(C)(C)CC4)cc2)cc1
• InChI: InChI=1S/C56H67N3O12S2.C52H65N3O11S2.C49H60N2O11S2/c1-34(2)30-59(73(65,66)42-17-15-40(67-6)16-18-42)32-46(60)38(28-50(61)71-48-33-69-56(5)45(48)21-24-68-56)25-35-11-13-39(14-12-35)58-23-20-41(31-58)70-47-27-37-10-8-7-9-36(37)26-43(47)52(62)57-53-51(54(63)64)44-29-55(3,4)22-19-49(44)72-53;1-32(2)29-54(68(61,62)39-16-14-38(63-6)15-17-39)30-43(56)34(26-47(58)66-44-31-65-52(5)42(44)20-23-64-52)24-33-9-11-36(12-10-33)53-28-35-25-37(55-22-7-8-46(55)57)13-18-40(35)49-48(50(59)60)41-27-51(3,4)21-19-45(41)67-49;1-30(2)27-51(64(57,58)36-16-14-35(59-5)15-17-36)28-41(53)33(23-45(54)62-42-29-61-48-38(42)19-21-60-48)22-31-10-12-34(13-11-31)50-26-32-8-6-7-9-37(32)40(52)24-44-46(47(55)56)39-25-49(3,4)20-18-43(39)63-44/h7-18,26-27,34,38,41,45-46,48,60H,19-25,28-33H2,1-6H3,(H,57,62)(H,63,64);9-18,25,32,34,42-44,53,56H,7-8,19-24,26-31H2,1-6H3,(H,59,60);6-17,30,33,38,41-42,48,50,53H,18-29H2,1-5H3,(H,55,56)/t38-,41+,45+,46-,48+,56-;34-,42+,43-,44+,52-;33-,38+,41-,42+,48-/m111/s1
• InChIKey: HLDXAKPRXIBNQI-LUEPBKKWSA-N
• XLogP: 24.88
• TPSA: 549.71 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 37
• Rotatable Bonds: 58
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2927.69
LogP ≤ 5	24.88
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid?

The IUPAC name of 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid (CID 158511911) is 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid.

What is the SMILES notation for 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid?

The canonical SMILES for 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid is COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@@]3(C)OCC[C@@H]23)Cc2ccc(N3CC[C@H](Oc4cc5ccccc5cc4C(=O)Nc4sc5c(c4C(=O)O)CC(C)(C)CC5)C3)cc2)cc1.COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@@]3(C)OCC[C@@H]23)Cc2ccc(NCc3cc(N4CCCC4=O)ccc3-c3sc4c(c3C(=O)O)CC(C)(C)CC4)cc2)cc1.COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@@H](CC(=O)O[C@H]2CO[C@H]3OCC[C@H]32)Cc2ccc(NCc3ccccc3C(=O)Cc3sc4c(c3C(=O)O)CC(C)(C)CC4)cc2)cc1.

What is the InChIKey of 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid?

The InChIKey is HLDXAKPRXIBNQI-LUEPBKKWSA-N. The full InChI is InChI=1S/C56H67N3O12S2.C52H65N3O11S2.C49H60N2O11S2/c1-34(2)30-59(73(65,66)42-17-15-40(67-6)16-18-42)32-46(60)38(28-50(61)71-48-33-69-56(5)45(48)21-24-68-56)25-35-11-13-39(14-12-35)58-23-20-41(31-58)70-47-27-37-10-8-7-9-36(37)26-43(47)52(62)57-53-51(54(63)64)44-29-55(3,4)22-19-49(44)72-53;1-32(2)29-54(68(61,62)39-16-14-38(63-6)15-17-39)30-43(56)34(26-47(58)66-44-31-65-52(5)42(44)20-23-64-52)24-33-9-11-36(12-10-33)53-28-35-25-37(55-22-7-8-46(55)57)13-18-40(35)49-48(50(59)60)41-27-51(3,4)21-19-45(41)67-49;1-30(2)27-51(64(57,58)36-16-14-35(59-5)15-17-36)28-41(53)33(23-45(54)62-42-29-61-48-38(42)19-21-60-48)22-31-10-12-34(13-11-31)50-26-32-8-6-7-9-37(32)40(52)24-44-46(47(55)56)39-25-49(3,4)20-18-43(39)63-44/h7-18,26-27,34,38,41,45-46,48,60H,19-25,28-33H2,1-6H3,(H,57,62)(H,63,64);9-18,25,32,34,42-44,53,56H,7-8,19-24,26-31H2,1-6H3,(H,59,60);6-17,30,33,38,41-42,48,50,53H,18-29H2,1-5H3,(H,55,56)/t38-,41+,45+,46-,48+,56-;34-,42+,43-,44+,52-;33-,38+,41-,42+,48-/m111/s1.

What are the key properties of 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid?

2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid has a molecular weight of 2927.69 g/mol, XLogP of 24.88, 58 rotatable bonds, 9 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]phenyl]-2-oxoethyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[2-[[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]anilino]methyl]-4-(2-oxopyrrolidin-1-yl)phenyl]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid;2-[[3-[(3S)-1-[4-[(2R,3S)-2-[2-[[(3aS,4R,6aR)-6a-methyl-3,3a,4,5-tetrahydro-2H-furo[2,3-b]furan-4-yl]oxy]-2-oxoethyl]-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]butyl]phenyl]pyrrolidin-3-yl]oxynaphthalene-2-carbonyl]amino]-5,5-dimethyl-6,7-dihydro-4H-1-benzothiophene-3-carboxylic acid is sourced from PubChem (CID 158511911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).