(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol

C108H94ClF25N8O12 — CID 159312422

IUPAC(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
SMILESCOc1cc2ccc([C@@H]3CN(Cc4cccc(OC(F)(F)F)c4)c4ccccc4N3C[C@@H](O)C(F)(F)F)cc2cc1OC.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(Cl)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(F)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc2c(c1)OCCO2)C(F)(F)F
InChIInChI=1S/C31H28F6N2O4.C27H24F6N2O4.C25H21ClF6N2O2.C25H21F7N2O2/c1-41-27-14-20-10-11-21(13-22(20)15-28(27)42-2)26-17-38(16-19-6-5-7-23(12-19)43-31(35,36)37)24-8-3-4-9-25(24)39(26)18-29(40)30(32,33)34;28-26(29,30)25(36)16-35-21-7-2-1-6-20(21)34(14-17-4-3-5-19(12-17)39-27(31,32)33)15-22(35)18-8-9-23-24(13-18)38-11-10-37-23;2*26-18-10-8-17(9-11-18)22-14-33(13-16-4-3-5-19(12-16)36-25(30,31)32)20-6-1-2-7-21(20)34(22)15-23(35)24(27,28)29/h3-15,26,29,40H,16-18H2,1-2H3;1-9,12-13,22,25,36H,10-11,14-16H2;2*1-12,22-23,35H,13-15H2/t26-,29+;22-,25+;2*22-,23+/m0000/s1
InChIKeyLCSGNKOHJYKDBX-WSPQXCNISA-N
MW2206.39 g/mol
LogP26.04
Rot. Bonds26

About (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol

(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol (PubChem CID 159312422) has the molecular formula C108H94ClF25N8O12 and a molecular weight of 2206.39 g/mol. Its IUPAC name is (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol.

Molecular Properties

Compound Name(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
PubChem CID159312422
Molecular FormulaC108H94ClF25N8O12
Molecular Weight2206.39 g/mol
Exact Mass2204.63
IUPAC Name(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
SMILESCOc1cc2ccc([C@@H]3CN(Cc4cccc(OC(F)(F)F)c4)c4ccccc4N3C[C@@H](O)C(F)(F)F)cc2cc1OC.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(Cl)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(F)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc2c(c1)OCCO2)C(F)(F)F
InChIInChI=1S/C31H28F6N2O4.C27H24F6N2O4.C25H21ClF6N2O2.C25H21F7N2O2/c1-41-27-14-20-10-11-21(13-22(20)15-28(27)42-2)26-17-38(16-19-6-5-7-23(12-19)43-31(35,36)37)24-8-3-4-9-25(24)39(26)18-29(40)30(32,33)34;28-26(29,30)25(36)16-35-21-7-2-1-6-20(21)34(14-17-4-3-5-19(12-17)39-27(31,32)33)15-22(35)18-8-9-23-24(13-18)38-11-10-37-23;2*26-18-10-8-17(9-11-18)22-14-33(13-16-4-3-5-19(12-16)36-25(30,31)32)20-6-1-2-7-21(20)34(22)15-23(35)24(27,28)29/h3-15,26,29,40H,16-18H2,1-2H3;1-9,12-13,22,25,36H,10-11,14-16H2;2*1-12,22-23,35H,13-15H2/t26-,29+;22-,25+;2*22-,23+/m0000/s1
InChIKeyLCSGNKOHJYKDBX-WSPQXCNISA-N
XLogP26.04
TPSA180.68 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002206.39
LogP ≤ 526.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol with MolForge

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Launch Full Analysis

Related Compounds

(2R)-3-[(2R)-4-(cyclohexen-1-ylmethyl)-2-[3-(trifluoromethoxy)phenyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[7,8-difluoro-4-[[3-(trifluoromethoxy)phenyl]methyl]-2-[3-(trifluoromethyl)phenyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-4-(oxan-4-ylmethyl)-2-[3-(trifluoromethoxy)phenyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[2-(4-phenylphenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
CID 158972995
(2R)-3-[2-[3-(difluoromethoxy)phenyl]-4-[[3-(difluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[2-[3-(difluoromethoxy)phenyl]-6-fluoro-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[2-[4-(2-hydroxypropan-2-yl)phenyl]-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-[3-(trifluoromethyl)phenyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
CID 159239553
2,7-Bis(4-ethoxynaphthalen-1-yl)-5,10-di(propan-2-yl)phenazine;2,7-bis(4-methoxy-2,6-dimethylphenyl)-5,10-dimethylphenazine;2,7-bis(4-methoxy-2,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;2,7-bis(4-methoxy-3,5-dimethylphenyl)-5,10-di(propan-2-yl)phenazine;2,7-bis(4-methoxy-2-methylphenyl)-5,10-dimethylphenazine;2,7-bis(4-methoxy-2-methylphenyl)-5,10-di(propan-2-yl)phenazine;2,7-bis[4-methoxy-2-(trifluoromethyl)phenyl]-5,10-bis(2-methylpropyl)phenazine;2,7-bis(4-phenoxy-2-propan-2-ylphenyl)-5,10-di(propan-2-yl)phenazine;5,10-diethyl-2,7-bis(4-methoxy-2-phenylphenyl)phenazine;2-(3,4-dimethoxyphenyl)-5,10-dimethyl-7-[4-(trifluoromethoxy)phenyl]phenazine;5,10-dimethyl-2,7-bis(2-methyl-4-propan-2-yloxyphenyl)phenazine;2-(3-fluoro-4-methoxyphenyl)-5,10-dimethyl-7-(4-methylphenyl)phenazine
CID 160662334
(2R)-3-[(2R)-4-[(4-chloro-3-ethylphenyl)methyl]-2-phenyl-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-4-[(3-ethoxyphenyl)methyl]-2-phenyl-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-4-[(2-fluoro-5-methylphenyl)methyl]-2-phenyl-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-4-[(3-fluorophenyl)methyl]-2-phenyl-2,3-dihydroquinoxalin-1-yl]propan-2-ol
CID 161429363
(2R)-1,1,1-trifluoro-3-[4-(1H-inden-1-yl)-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-methoxyphenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-methylphenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-naphthalen-1-yl-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol
CID 162207814

Frequently Asked Questions

What is the IUPAC name of (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol?
The IUPAC name of (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol (CID 159312422) is (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol.
What is the SMILES notation for (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol?
The canonical SMILES for (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol is COc1cc2ccc([C@@H]3CN(Cc4cccc(OC(F)(F)F)c4)c4ccccc4N3C[C@@H](O)C(F)(F)F)cc2cc1OC.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(Cl)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc(F)cc1)C(F)(F)F.O[C@H](CN1c2ccccc2N(Cc2cccc(OC(F)(F)F)c2)C[C@H]1c1ccc2c(c1)OCCO2)C(F)(F)F.
What is the InChIKey of (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol?
The InChIKey is LCSGNKOHJYKDBX-WSPQXCNISA-N. The full InChI is InChI=1S/C31H28F6N2O4.C27H24F6N2O4.C25H21ClF6N2O2.C25H21F7N2O2/c1-41-27-14-20-10-11-21(13-22(20)15-28(27)42-2)26-17-38(16-19-6-5-7-23(12-19)43-31(35,36)37)24-8-3-4-9-25(24)39(26)18-29(40)30(32,33)34;28-26(29,30)25(36)16-35-21-7-2-1-6-20(21)34(14-17-4-3-5-19(12-17)39-27(31,32)33)15-22(35)18-8-9-23-24(13-18)38-11-10-37-23;2*26-18-10-8-17(9-11-18)22-14-33(13-16-4-3-5-19(12-16)36-25(30,31)32)20-6-1-2-7-21(20)34(22)15-23(35)24(27,28)29/h3-15,26,29,40H,16-18H2,1-2H3;1-9,12-13,22,25,36H,10-11,14-16H2;2*1-12,22-23,35H,13-15H2/t26-,29+;22-,25+;2*22-,23+/m0000/s1.
What are the key properties of (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol?
(2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol has a molecular weight of 2206.39 g/mol, XLogP of 26.04, 26 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-[(2R)-2-(4-chlorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-3-[(2R)-2-(6,7-dimethoxynaphthalen-2-yl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]-1,1,1-trifluoropropan-2-ol;(2R)-1,1,1-trifluoro-3-[(2R)-2-(4-fluorophenyl)-4-[[3-(trifluoromethoxy)phenyl]methyl]-2,3-dihydroquinoxalin-1-yl]propan-2-ol is sourced from PubChem (CID 159312422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).