1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol

C195H199Cl2N11O19 — CID 159276881

IUPAC1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol
SMILESCOc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.N#Cc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.N#Cc1ccccc1-c1cccc(OCC(O)CN2CCc3ccccc3C2)c1.OC(COc1cccc(-c2cccc(Cl)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccccc2Cl)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccncc2)c1)CN1CCc2ccccc2C1.Oc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.Oc1cccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c1
InChIInChI=1S/C26H29NO3.2C25H24N2O2.2C24H24ClNO2.2C24H25NO3.C23H24N2O2/c1-19-14-24(29-2)10-11-26(19)21-8-5-9-25(15-21)30-18-23(28)17-27-13-12-20-6-3-4-7-22(20)16-27;26-15-21-7-3-4-11-25(21)20-9-5-10-24(14-20)29-18-23(28)17-27-13-12-19-6-1-2-8-22(19)16-27;26-15-19-8-10-21(11-9-19)22-6-3-7-25(14-22)29-18-24(28)17-27-13-12-20-4-1-2-5-23(20)16-27;25-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-26-12-11-18-5-1-2-6-21(18)15-26;25-24-11-4-3-10-23(24)19-8-5-9-22(14-19)28-17-21(27)16-26-13-12-18-6-1-2-7-20(18)15-26;26-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-25-12-11-18-5-1-2-6-21(18)15-25;26-22-10-8-19(9-11-22)20-6-3-7-24(14-20)28-17-23(27)16-25-13-12-18-4-1-2-5-21(18)15-25;26-22(16-25-13-10-18-4-1-2-5-21(18)15-25)17-27-23-7-3-6-20(14-23)19-8-11-24-12-9-19/h3-11,14-15,23,28H,12-13,16-18H2,1-2H3;1-11,14,23,28H,12-13,16-18H2;1-11,14,24,28H,12-13,16-18H2;1-10,13-14,23,27H,11-12,15-17H2;1-11,14,21,27H,12-13,15-17H2;1-10,13-14,23,26-27H,11-12,15-17H2;1-11,14,23,26-27H,12-13,15-17H2;1-9,11-12,14,22,26H,10,13,15-17H2
InChIKeyKYKOHRKTRNSDFQ-UHFFFAOYSA-N
MW3071.70 g/mol
LogP33.39
Rot. Bonds49

About 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol

1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol (PubChem CID 159276881) has the molecular formula C195H199Cl2N11O19 and a molecular weight of 3071.70 g/mol. Its IUPAC name is 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol
PubChem CID159276881
Molecular FormulaC195H199Cl2N11O19
Molecular Weight3071.70 g/mol
Exact Mass3068.43
IUPAC Name1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol
SMILESCOc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.N#Cc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.N#Cc1ccccc1-c1cccc(OCC(O)CN2CCc3ccccc3C2)c1.OC(COc1cccc(-c2cccc(Cl)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccccc2Cl)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccncc2)c1)CN1CCc2ccccc2C1.Oc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.Oc1cccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c1
InChIInChI=1S/C26H29NO3.2C25H24N2O2.2C24H24ClNO2.2C24H25NO3.C23H24N2O2/c1-19-14-24(29-2)10-11-26(19)21-8-5-9-25(15-21)30-18-23(28)17-27-13-12-20-6-3-4-7-22(20)16-27;26-15-21-7-3-4-11-25(21)20-9-5-10-24(14-20)29-18-23(28)17-27-13-12-19-6-1-2-8-22(19)16-27;26-15-19-8-10-21(11-9-19)22-6-3-7-25(14-22)29-18-24(28)17-27-13-12-20-4-1-2-5-23(20)16-27;25-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-26-12-11-18-5-1-2-6-21(18)15-26;25-24-11-4-3-10-23(24)19-8-5-9-22(14-19)28-17-21(27)16-26-13-12-18-6-1-2-7-20(18)15-26;26-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-25-12-11-18-5-1-2-6-21(18)15-25;26-22-10-8-19(9-11-22)20-6-3-7-24(14-20)28-17-23(27)16-25-13-12-18-4-1-2-5-21(18)15-25;26-22(16-25-13-10-18-4-1-2-5-21(18)15-25)17-27-23-7-3-6-20(14-23)19-8-11-24-12-9-19/h3-11,14-15,23,28H,12-13,16-18H2,1-2H3;1-11,14,23,28H,12-13,16-18H2;1-11,14,24,28H,12-13,16-18H2;1-10,13-14,23,27H,11-12,15-17H2;1-11,14,21,27H,12-13,15-17H2;1-10,13-14,23,26-27H,11-12,15-17H2;1-11,14,23,26-27H,12-13,15-17H2;1-9,11-12,14,22,26H,10,13,15-17H2
InChIKeyKYKOHRKTRNSDFQ-UHFFFAOYSA-N
XLogP33.39
TPSA371.76 Ų
H-Bond Donors10
H-Bond Acceptors30
Rotatable Bonds49
Heavy Atoms227
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003071.70
LogP ≤ 533.39
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1030

Analyze 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol?
The IUPAC name of 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol (CID 159276881) is 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol.
What is the SMILES notation for 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol?
The canonical SMILES for 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol is COc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.N#Cc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.N#Cc1ccccc1-c1cccc(OCC(O)CN2CCc3ccccc3C2)c1.OC(COc1cccc(-c2cccc(Cl)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccccc2Cl)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccncc2)c1)CN1CCc2ccccc2C1.Oc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)cc1.Oc1cccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c1.
What is the InChIKey of 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol?
The InChIKey is KYKOHRKTRNSDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO3.2C25H24N2O2.2C24H24ClNO2.2C24H25NO3.C23H24N2O2/c1-19-14-24(29-2)10-11-26(19)21-8-5-9-25(15-21)30-18-23(28)17-27-13-12-20-6-3-4-7-22(20)16-27;26-15-21-7-3-4-11-25(21)20-9-5-10-24(14-20)29-18-23(28)17-27-13-12-19-6-1-2-8-22(19)16-27;26-15-19-8-10-21(11-9-19)22-6-3-7-25(14-22)29-18-24(28)17-27-13-12-20-4-1-2-5-23(20)16-27;25-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-26-12-11-18-5-1-2-6-21(18)15-26;25-24-11-4-3-10-23(24)19-8-5-9-22(14-19)28-17-21(27)16-26-13-12-18-6-1-2-7-20(18)15-26;26-22-9-3-7-19(13-22)20-8-4-10-24(14-20)28-17-23(27)16-25-12-11-18-5-1-2-6-21(18)15-25;26-22-10-8-19(9-11-22)20-6-3-7-24(14-20)28-17-23(27)16-25-13-12-18-4-1-2-5-21(18)15-25;26-22(16-25-13-10-18-4-1-2-5-21(18)15-25)17-27-23-7-3-6-20(14-23)19-8-11-24-12-9-19/h3-11,14-15,23,28H,12-13,16-18H2,1-2H3;1-11,14,23,28H,12-13,16-18H2;1-11,14,24,28H,12-13,16-18H2;1-10,13-14,23,27H,11-12,15-17H2;1-11,14,21,27H,12-13,15-17H2;1-10,13-14,23,26-27H,11-12,15-17H2;1-11,14,23,26-27H,12-13,15-17H2;1-9,11-12,14,22,26H,10,13,15-17H2.
What are the key properties of 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol?
1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol has a molecular weight of 3071.70 g/mol, XLogP of 33.39, 49 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(3-chlorophenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;2-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]benzonitrile;3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;4-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropoxy]phenyl]phenol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(4-methoxy-2-methylphenyl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-pyridin-4-ylphenoxy)propan-2-ol is sourced from PubChem (CID 159276881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).