2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

C125H155N5O29 — CID 159763076

IUPAC2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
SMILESCOC(=O)C1c2ccc(OCc3ccc(C)c(C)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3c(C)cc(C)cc3C)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3cc(C)ccc3OC)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccc(OC)c(OC)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccccc3OC)cc2CCN1C(=O)OC(C)(C)C
InChIInChI=1S/C26H33NO5.C25H31NO7.C25H31NO6.C25H31NO5.C24H29NO6/c1-16-12-17(2)22(18(3)13-16)15-31-20-8-9-21-19(14-20)10-11-27(23(21)24(28)30-7)25(29)32-26(4,5)6;1-25(2,3)33-24(28)26-12-11-17-14-18(8-9-19(17)22(26)23(27)31-6)32-15-16-7-10-20(29-4)21(13-16)30-5;1-16-7-10-21(29-5)18(13-16)15-31-19-8-9-20-17(14-19)11-12-26(22(20)23(27)30-6)24(28)32-25(2,3)4;1-16-7-8-18(13-17(16)2)15-30-20-9-10-21-19(14-20)11-12-26(22(21)23(27)29-6)24(28)31-25(3,4)5;1-24(2,3)31-23(27)25-13-12-16-14-18(10-11-19(16)21(25)22(26)29-5)30-15-17-8-6-7-9-20(17)28-4/h8-9,12-14,23H,10-11,15H2,1-7H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;6-11,14,21H,12-13,15H2,1-5H3/t23-;2*22-;;21-/m111.1/s1
InChIKeyNFDJXRTZCNIVRM-NQVKTNBQSA-N
MW2191.62 g/mol
LogP23.25
Rot. Bonds24

About 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate (PubChem CID 159763076) has the molecular formula C125H155N5O29 and a molecular weight of 2191.62 g/mol. Its IUPAC name is 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate.

Molecular Properties

Compound Name2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
PubChem CID159763076
Molecular FormulaC125H155N5O29
Molecular Weight2191.62 g/mol
Exact Mass2190.08
IUPAC Name2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
SMILESCOC(=O)C1c2ccc(OCc3ccc(C)c(C)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3c(C)cc(C)cc3C)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3cc(C)ccc3OC)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccc(OC)c(OC)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccccc3OC)cc2CCN1C(=O)OC(C)(C)C
InChIInChI=1S/C26H33NO5.C25H31NO7.C25H31NO6.C25H31NO5.C24H29NO6/c1-16-12-17(2)22(18(3)13-16)15-31-20-8-9-21-19(14-20)10-11-27(23(21)24(28)30-7)25(29)32-26(4,5)6;1-25(2,3)33-24(28)26-12-11-17-14-18(8-9-19(17)22(26)23(27)31-6)32-15-16-7-10-20(29-4)21(13-16)30-5;1-16-7-10-21(29-5)18(13-16)15-31-19-8-9-20-17(14-19)11-12-26(22(20)23(27)30-6)24(28)32-25(2,3)4;1-16-7-8-18(13-17(16)2)15-30-20-9-10-21-19(14-20)11-12-26(22(21)23(27)29-6)24(28)31-25(3,4)5;1-24(2,3)31-23(27)25-13-12-16-14-18(10-11-19(16)21(25)22(26)29-5)30-15-17-8-6-7-9-20(17)28-4/h8-9,12-14,23H,10-11,15H2,1-7H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;6-11,14,21H,12-13,15H2,1-5H3/t23-;2*22-;;21-/m111.1/s1
InChIKeyNFDJXRTZCNIVRM-NQVKTNBQSA-N
XLogP23.25
TPSA362.27 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds24
Heavy Atoms159
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002191.62
LogP ≤ 523.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-Benzyloxy-2-diphenylacetyl-6-methoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid ethyl ester
CID 15296725
2-Diphenylacetyl-6-methoxy-5-(4-methoxy-3-methyl-benzyloxy)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid
CID 22402434
tert-butyl (1R,3S,6R,11aS)-3-[(3,4-dimethoxyphenyl)methyl]-1,7,8,10-tetramethoxy-9-methyl-4-oxo-6-(phenylmethoxymethyl)-3,6,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinoline-2-carboxylate
CID 46937300
tert-butyl (3S,6R,11aS)-3-benzyl-7,8,10-trimethoxy-9-methyl-4-oxo-6-(phenylmethoxymethyl)-3,6,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinoline-2-carboxylate
CID 49866066
propan-2-yl (1R,3S,6R,11aS)-3-[(3,4-dimethoxyphenyl)methyl]-1,7,8,10-tetramethoxy-9-methyl-4-oxo-6-(phenylmethoxymethyl)-3,6,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinoline-2-carboxylate
CID 49866125
propan-2-yl (1R,2S,10R,13S)-5,7,8-trimethoxy-6-methyl-12-oxo-10-(phenylmethoxymethyl)-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),5,7,15,17,19-hexaene-21-carboxylate
CID 49866128
propan-2-yl (1R,2S,10R,13S)-8-ethyl-5,7,17,18-tetramethoxy-6,13-dimethyl-12-oxo-10-(phenylmethoxymethyl)-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),5,7,15,17,19-hexaene-21-carboxylate
CID 49866130
propan-2-yl (3S,6R,11aS)-3-benzyl-7,8,10-trimethoxy-9-methyl-4-oxo-6-(phenylmethoxymethyl)-3,6,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinoline-2-carboxylate
CID 49866065
propan-2-yl (1R,3S,6R,11aS)-3-benzyl-1,7,8,10-tetramethoxy-9-methyl-4-oxo-6-(phenylmethoxymethyl)-3,6,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinoline-2-carboxylate
CID 49866124
ethyl 2-[(1S,14S)-9,20,21,25-tetramethoxy-15,30-dimethyl-7,23-dioxa-15-aza-30-azoniaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-30-yl]butanoate bromide
CID 137656960
(RS)-2-(Diphenylacetyl)-1,2,3,4-tetrahydro-6-methoxy-5-[(4-methoxy-3-methylphenyl)methoxy]-3-isoquinolinecarboxylic acid, ethyl ester
CID 15230314
2-O-tert-butyl 1-O-methyl (1R)-6-[(2,6-difluorophenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(4-fluoro-3-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(4-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[[2-(trifluoromethoxy)phenyl]methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
CID 90832400

Frequently Asked Questions

What is the IUPAC name of 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate?
The IUPAC name of 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate (CID 159763076) is 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate.
What is the SMILES notation for 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate?
The canonical SMILES for 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate is COC(=O)C1c2ccc(OCc3ccc(C)c(C)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3c(C)cc(C)cc3C)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3cc(C)ccc3OC)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccc(OC)c(OC)c3)cc2CCN1C(=O)OC(C)(C)C.COC(=O)[C@H]1c2ccc(OCc3ccccc3OC)cc2CCN1C(=O)OC(C)(C)C.
What is the InChIKey of 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate?
The InChIKey is NFDJXRTZCNIVRM-NQVKTNBQSA-N. The full InChI is InChI=1S/C26H33NO5.C25H31NO7.C25H31NO6.C25H31NO5.C24H29NO6/c1-16-12-17(2)22(18(3)13-16)15-31-20-8-9-21-19(14-20)10-11-27(23(21)24(28)30-7)25(29)32-26(4,5)6;1-25(2,3)33-24(28)26-12-11-17-14-18(8-9-19(17)22(26)23(27)31-6)32-15-16-7-10-20(29-4)21(13-16)30-5;1-16-7-10-21(29-5)18(13-16)15-31-19-8-9-20-17(14-19)11-12-26(22(20)23(27)30-6)24(28)32-25(2,3)4;1-16-7-8-18(13-17(16)2)15-30-20-9-10-21-19(14-20)11-12-26(22(21)23(27)29-6)24(28)31-25(3,4)5;1-24(2,3)31-23(27)25-13-12-16-14-18(10-11-19(16)21(25)22(26)29-5)30-15-17-8-6-7-9-20(17)28-4/h8-9,12-14,23H,10-11,15H2,1-7H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;7-10,13-14,22H,11-12,15H2,1-6H3;6-11,14,21H,12-13,15H2,1-5H3/t23-;2*22-;;21-/m111.1/s1.
What are the key properties of 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate?
2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate has a molecular weight of 2191.62 g/mol, XLogP of 23.25, 24 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-O-tert-butyl 1-O-methyl (1R)-6-[(3,4-dimethoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl 6-[(3,4-dimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxy-5-methylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2-methoxyphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate;2-O-tert-butyl 1-O-methyl (1R)-6-[(2,4,6-trimethylphenyl)methoxy]-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate is sourced from PubChem (CID 159763076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).