1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol

C184H184ClF3N10O19 — CID 162183950

IUPAC1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol
SMILESCOc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.COc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(Cl)c1.OC(COc1cccc(-c2ccc3c(c2)CN=N3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccc3c(c2)OCCO3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc(C(F)(F)F)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc3c2oc2ccccc23)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cnc3ccccc3c2)c1)CN1CCc2ccccc2C1
InChIInChI=1S/C30H27NO3.C27H26N2O2.C26H27NO4.C26H29NO3.C25H26ClNO3.C25H24F3NO2.C25H25N3O2/c32-24(19-31-16-15-21-7-1-2-8-23(21)18-31)20-33-25-10-5-9-22(17-25)26-12-6-13-28-27-11-3-4-14-29(27)34-30(26)28;30-25(18-29-13-12-20-6-1-2-8-23(20)17-29)19-31-26-10-5-9-21(15-26)24-14-22-7-3-4-11-27(22)28-16-24;28-23(17-27-11-10-19-4-1-2-5-22(19)16-27)18-31-24-7-3-6-20(14-24)21-8-9-25-26(15-21)30-13-12-29-25;1-19-14-24(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;1-29-22-9-10-24(25(26)14-22)19-7-4-8-23(13-19)30-17-21(28)16-27-12-11-18-5-2-3-6-20(18)15-27;26-25(27,28)22-9-3-7-19(13-22)20-8-4-10-24(14-20)31-17-23(30)16-29-12-11-18-5-1-2-6-21(18)15-29;29-23(16-28-11-10-18-4-1-2-5-21(18)15-28)17-30-24-7-3-6-19(13-24)20-8-9-25-22(12-20)14-26-27-25/h1-14,17,24,32H,15-16,18-20H2;1-11,14-16,25,30H,12-13,17-19H2;1-9,14-15,23,28H,10-13,16-18H2;3-11,14-15,23,28H,12-13,16-18H2,1-2H3;2-10,13-14,21,28H,11-12,15-17H2,1H3;1-10,13-14,23,30H,11-12,15-17H2;1-9,12-13,23,29H,10-11,14-17H2
InChIKeyZPKJCGVVOWTAIF-UHFFFAOYSA-N
MW2931.99 g/mol
LogP33.88
Rot. Bonds44

About 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol

1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol (PubChem CID 162183950) has the molecular formula C184H184ClF3N10O19 and a molecular weight of 2931.99 g/mol. Its IUPAC name is 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol.

Molecular Properties

Compound Name1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol
PubChem CID162183950
Molecular FormulaC184H184ClF3N10O19
Molecular Weight2931.99 g/mol
Exact Mass2929.34
IUPAC Name1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol
SMILESCOc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.COc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(Cl)c1.OC(COc1cccc(-c2ccc3c(c2)CN=N3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccc3c(c2)OCCO3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc(C(F)(F)F)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc3c2oc2ccccc23)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cnc3ccccc3c2)c1)CN1CCc2ccccc2C1
InChIInChI=1S/C30H27NO3.C27H26N2O2.C26H27NO4.C26H29NO3.C25H26ClNO3.C25H24F3NO2.C25H25N3O2/c32-24(19-31-16-15-21-7-1-2-8-23(21)18-31)20-33-25-10-5-9-22(17-25)26-12-6-13-28-27-11-3-4-14-29(27)34-30(26)28;30-25(18-29-13-12-20-6-1-2-8-23(20)17-29)19-31-26-10-5-9-21(15-26)24-14-22-7-3-4-11-27(22)28-16-24;28-23(17-27-11-10-19-4-1-2-5-22(19)16-27)18-31-24-7-3-6-20(14-24)21-8-9-25-26(15-21)30-13-12-29-25;1-19-14-24(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;1-29-22-9-10-24(25(26)14-22)19-7-4-8-23(13-19)30-17-21(28)16-27-12-11-18-5-2-3-6-20(18)15-27;26-25(27,28)22-9-3-7-19(13-22)20-8-4-10-24(14-20)31-17-23(30)16-29-12-11-18-5-1-2-6-21(18)15-29;29-23(16-28-11-10-18-4-1-2-5-21(18)15-28)17-30-24-7-3-6-19(13-24)20-8-9-25-22(12-20)14-26-27-25/h1-14,17,24,32H,15-16,18-20H2;1-11,14-16,25,30H,12-13,17-19H2;1-9,14-15,23,28H,10-13,16-18H2;3-11,14-15,23,28H,12-13,16-18H2,1-2H3;2-10,13-14,21,28H,11-12,15-17H2,1H3;1-10,13-14,23,30H,11-12,15-17H2;1-9,12-13,23,29H,10-11,14-17H2
InChIKeyZPKJCGVVOWTAIF-UHFFFAOYSA-N
XLogP33.88
TPSA316.57 Ų
H-Bond Donors7
H-Bond Acceptors29
Rotatable Bonds44
Heavy Atoms217
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002931.99
LogP ≤ 533.88
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1029

Analyze 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol with MolForge

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Launch Full Analysis

Related Compounds

1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indol-5-yl)phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-[(4-methoxyphenyl)methyl]benzimidazol-5-yl]phenoxy]propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol
CID 157448507
1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-[3-(1,1-difluoroethyl)phenyl]phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;bis(1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indol-5-yl)phenoxy]propan-2-ol)
CID 159577295
15-Chloro-8-[2-(dimethylamino)ethyl]-3,5-difluoro-16-phenyl-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaen-8-ol;1-(2-chloro-4-phenylquinolin-6-yl)-3-(dimethylamino)-1-(furan-2-yl)propan-1-ol;1-(2-chloro-3-phenylquinolin-5-yl)-3-(dimethylamino)-1-naphthalen-1-ylpropan-1-ol;1-(2-chloro-3-phenylquinolin-5-yl)-3-(dimethylamino)-1-phenylpropan-1-ol;1-(2-chloro-4-phenylquinolin-6-yl)-3-(dimethylamino)-1-phenylpropan-1-ol;1-(2-chloro-4-phenylquinolin-6-yl)-3-(dimethylamino)-1-pyridin-2-ylpropan-1-ol
CID 161126645

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol?
The IUPAC name of 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol (CID 162183950) is 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol.
What is the SMILES notation for 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol?
The canonical SMILES for 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol is COc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(C)c1.COc1ccc(-c2cccc(OCC(O)CN3CCc4ccccc4C3)c2)c(Cl)c1.OC(COc1cccc(-c2ccc3c(c2)CN=N3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2ccc3c(c2)OCCO3)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc(C(F)(F)F)c2)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cccc3c2oc2ccccc23)c1)CN1CCc2ccccc2C1.OC(COc1cccc(-c2cnc3ccccc3c2)c1)CN1CCc2ccccc2C1.
What is the InChIKey of 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol?
The InChIKey is ZPKJCGVVOWTAIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27NO3.C27H26N2O2.C26H27NO4.C26H29NO3.C25H26ClNO3.C25H24F3NO2.C25H25N3O2/c32-24(19-31-16-15-21-7-1-2-8-23(21)18-31)20-33-25-10-5-9-22(17-25)26-12-6-13-28-27-11-3-4-14-29(27)34-30(26)28;30-25(18-29-13-12-20-6-1-2-8-23(20)17-29)19-31-26-10-5-9-21(15-26)24-14-22-7-3-4-11-27(22)28-16-24;28-23(17-27-11-10-19-4-1-2-5-22(19)16-27)18-31-24-7-3-6-20(14-24)21-8-9-25-26(15-21)30-13-12-29-25;1-19-14-24(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;1-29-22-9-10-24(25(26)14-22)19-7-4-8-23(13-19)30-17-21(28)16-27-12-11-18-5-2-3-6-20(18)15-27;26-25(27,28)22-9-3-7-19(13-22)20-8-4-10-24(14-20)31-17-23(30)16-29-12-11-18-5-1-2-6-21(18)15-29;29-23(16-28-11-10-18-4-1-2-5-21(18)15-28)17-30-24-7-3-6-19(13-24)20-8-9-25-22(12-20)14-26-27-25/h1-14,17,24,32H,15-16,18-20H2;1-11,14-16,25,30H,12-13,17-19H2;1-9,14-15,23,28H,10-13,16-18H2;3-11,14-15,23,28H,12-13,16-18H2,1-2H3;2-10,13-14,21,28H,11-12,15-17H2,1H3;1-10,13-14,23,30H,11-12,15-17H2;1-9,12-13,23,29H,10-11,14-17H2.
What are the key properties of 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol?
1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol has a molecular weight of 2931.99 g/mol, XLogP of 33.88, 44 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-chloro-4-methoxyphenyl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3-dibenzofuran-4-ylphenoxy)-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenoxy]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(3H-indazol-5-yl)phenoxy]propan-2-ol;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-quinolin-3-ylphenoxy)propan-2-ol;1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[3-(trifluoromethyl)phenyl]phenoxy]propan-2-ol is sourced from PubChem (CID 162183950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).