bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane

C157H221N7O22 — CID 158469723

IUPACbis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane
SMILESC1CCOC1.C1CCOC1.COc1ccc(CC2C3=C(CCCC3)CCN2C(=O)C2CCC2)cc1.COc1ccc(CC2NCCC3=C2CCCC3)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1.COc1ccc(C[C@@H]2N(CC3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1
InChIInChI=1S/2C22H31NO4.2C22H29NO3.C22H33NO3.C22H29NO2.C17H23NO.2C4H8O/c2*1-27-18-9-7-16(8-10-18)15-19-22(26)12-3-2-11-21(22,25)13-14-23(19)20(24)17-5-4-6-17;2*1-25-18-9-7-16(8-10-18)15-19-22-12-3-2-11-21(22,26-22)13-14-23(19)20(24)17-5-4-6-17;1-26-19-9-7-17(8-10-19)15-20-22(25)12-3-2-11-21(22,24)13-14-23(20)16-18-5-4-6-18;1-25-19-11-9-16(10-12-19)15-21-20-8-3-2-5-17(20)13-14-23(21)22(24)18-6-4-7-18;1-19-15-8-6-13(7-9-15)12-17-16-5-3-2-4-14(16)10-11-18-17;2*1-2-4-5-3-1/h2*7-10,17,19,25-26H,2-6,11-15H2,1H3;2*7-10,17,19H,2-6,11-15H2,1H3;7-10,18,20,24-25H,2-6,11-16H2,1H3;9-12,18,21H,2-8,13-15H2,1H3;6-9,17-18H,2-5,10-12H2,1H3;2*1-4H2/t2*19-,21-,22-;19-,21+,22?;19-,21-,22?;20-,21-,22-;;;;/m00010..../s1
InChIKeyHGEXVTWMFMMLMU-ASNNQSMNSA-N
MW2558.52 g/mol
LogP25.51
Rot. Bonds28

About bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane

bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane (PubChem CID 158469723) has the molecular formula C157H221N7O22 and a molecular weight of 2558.52 g/mol. Its IUPAC name is bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane.

Molecular Properties

Compound Namebis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane
PubChem CID158469723
Molecular FormulaC157H221N7O22
Molecular Weight2558.52 g/mol
Exact Mass2556.64
IUPAC Namebis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane
SMILESC1CCOC1.C1CCOC1.COc1ccc(CC2C3=C(CCCC3)CCN2C(=O)C2CCC2)cc1.COc1ccc(CC2NCCC3=C2CCCC3)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1.COc1ccc(C[C@@H]2N(CC3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1
InChIInChI=1S/2C22H31NO4.2C22H29NO3.C22H33NO3.C22H29NO2.C17H23NO.2C4H8O/c2*1-27-18-9-7-16(8-10-18)15-19-22(26)12-3-2-11-21(22,25)13-14-23(19)20(24)17-5-4-6-17;2*1-25-18-9-7-16(8-10-18)15-19-22-12-3-2-11-21(22,26-22)13-14-23(19)20(24)17-5-4-6-17;1-26-19-9-7-17(8-10-19)15-20-22(25)12-3-2-11-21(22,24)13-14-23(20)16-18-5-4-6-18;1-25-19-11-9-16(10-12-19)15-21-20-8-3-2-5-17(20)13-14-23(21)22(24)18-6-4-7-18;1-19-15-8-6-13(7-9-15)12-17-16-5-3-2-4-14(16)10-11-18-17;2*1-2-4-5-3-1/h2*7-10,17,19,25-26H,2-6,11-15H2,1H3;2*7-10,17,19H,2-6,11-15H2,1H3;7-10,18,20,24-25H,2-6,11-16H2,1H3;9-12,18,21H,2-8,13-15H2,1H3;6-9,17-18H,2-5,10-12H2,1H3;2*1-4H2/t2*19-,21-,22-;19-,21+,22?;19-,21-,22?;20-,21-,22-;;;;/m00010..../s1
InChIKeyHGEXVTWMFMMLMU-ASNNQSMNSA-N
XLogP25.51
TPSA346.33 Ų
H-Bond Donors7
H-Bond Acceptors24
Rotatable Bonds28
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002558.52
LogP ≤ 525.51
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane?
The IUPAC name of bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane (CID 158469723) is bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane.
What is the SMILES notation for bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane?
The canonical SMILES for bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane is C1CCOC1.C1CCOC1.COc1ccc(CC2C3=C(CCCC3)CCN2C(=O)C2CCC2)cc1.COc1ccc(CC2NCCC3=C2CCCC3)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1.COc1ccc(C[C@@H]2N(CC3CCC3)CC[C@@]3(O)CCCC[C@]23O)cc1.COc1ccc(C[C@H]2N(C(=O)C3CCC3)CC[C@]34CCCCC23O4)cc1.
What is the InChIKey of bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane?
The InChIKey is HGEXVTWMFMMLMU-ASNNQSMNSA-N. The full InChI is InChI=1S/2C22H31NO4.2C22H29NO3.C22H33NO3.C22H29NO2.C17H23NO.2C4H8O/c2*1-27-18-9-7-16(8-10-18)15-19-22(26)12-3-2-11-21(22,25)13-14-23(19)20(24)17-5-4-6-17;2*1-25-18-9-7-16(8-10-18)15-19-22-12-3-2-11-21(22,26-22)13-14-23(19)20(24)17-5-4-6-17;1-26-19-9-7-17(8-10-19)15-20-22(25)12-3-2-11-21(22,24)13-14-23(20)16-18-5-4-6-18;1-25-19-11-9-16(10-12-19)15-21-20-8-3-2-5-17(20)13-14-23(21)22(24)18-6-4-7-18;1-19-15-8-6-13(7-9-15)12-17-16-5-3-2-4-14(16)10-11-18-17;2*1-2-4-5-3-1/h2*7-10,17,19,25-26H,2-6,11-15H2,1H3;2*7-10,17,19H,2-6,11-15H2,1H3;7-10,18,20,24-25H,2-6,11-16H2,1H3;9-12,18,21H,2-8,13-15H2,1H3;6-9,17-18H,2-5,10-12H2,1H3;2*1-4H2/t2*19-,21-,22-;19-,21+,22?;19-,21-,22?;20-,21-,22-;;;;/m00010..../s1.
What are the key properties of bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane?
bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane has a molecular weight of 2558.52 g/mol, XLogP of 25.51, 28 rotatable bonds, 7 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for bis([(1S,4aS,8aS)-4a,8a-dihydroxy-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]-cyclobutylmethanone);(1S,4aS,8aS)-2-(cyclobutylmethyl)-1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinoline-4a,8a-diol;cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone;cyclobutyl-[(2S,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;cyclobutyl-[(2R,6R)-2-[(4-methoxyphenyl)methyl]-11-oxa-3-azatricyclo[4.4.1.01,6]undecan-3-yl]methanone;1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline;oxolane is sourced from PubChem (CID 158469723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).