ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid

C95H102BBrF12N10O14 — CID 158642245

IUPACethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
SMILESC.CC.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Br)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Nc4ccc(C)nc4)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(B3OC(C)(C)C(C)(C)O3)ccc2C1=O.Cc1ccc(Nc2ccc(-c3ccc4c(c3)CCC(CC(=O)O)(CC(F)(F)F)C4=O)nn2)cn1
InChIInChI=1S/C26H25F3N4O3.C24H21F3N4O3.C22H28BF3O5.C20H18BrF3N2O3.C2H6.CH4/c1-3-36-23(34)13-25(15-26(27,28)29)11-10-17-12-18(5-7-20(17)24(25)35)21-8-9-22(33-32-21)31-19-6-4-16(2)30-14-19;1-14-2-4-17(12-28-14)29-20-7-6-19(30-31-20)16-3-5-18-15(10-16)8-9-23(22(18)34,11-21(32)33)13-24(25,26)27;1-6-29-17(27)12-21(13-22(24,25)26)10-9-14-11-15(7-8-16(14)18(21)28)23-30-19(2,3)20(4,5)31-23;1-2-29-17(27)10-19(11-20(22,23)24)8-7-12-9-13(3-4-14(12)18(19)28)15-5-6-16(21)26-25-15;1-2;/h4-9,12,14H,3,10-11,13,15H2,1-2H3,(H,31,33);2-7,10,12H,8-9,11,13H2,1H3,(H,29,31)(H,32,33);7-8,11H,6,9-10,12-13H2,1-5H3;3-6,9H,2,7-8,10-11H2,1H3;1-2H3;1H4
InChIKeyIANOBTNIPPRNBA-UHFFFAOYSA-N
MW1926.61 g/mol
LogP21.34
Rot. Bonds23

About ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid

ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid (PubChem CID 158642245) has the molecular formula C95H102BBrF12N10O14 and a molecular weight of 1926.61 g/mol. Its IUPAC name is ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid.

Molecular Properties

Compound Nameethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
PubChem CID158642245
Molecular FormulaC95H102BBrF12N10O14
Molecular Weight1926.61 g/mol
Exact Mass1924.67
IUPAC Nameethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
SMILESC.CC.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Br)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Nc4ccc(C)nc4)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(B3OC(C)(C)C(C)(C)O3)ccc2C1=O.Cc1ccc(Nc2ccc(-c3ccc4c(c3)CCC(CC(=O)O)(CC(F)(F)F)C4=O)nn2)cn1
InChIInChI=1S/C26H25F3N4O3.C24H21F3N4O3.C22H28BF3O5.C20H18BrF3N2O3.C2H6.CH4/c1-3-36-23(34)13-25(15-26(27,28)29)11-10-17-12-18(5-7-20(17)24(25)35)21-8-9-22(33-32-21)31-19-6-4-16(2)30-14-19;1-14-2-4-17(12-28-14)29-20-7-6-19(30-31-20)16-3-5-18-15(10-16)8-9-23(22(18)34,11-21(32)33)13-24(25,26)27;1-6-29-17(27)12-21(13-22(24,25)26)10-9-14-11-15(7-8-16(14)18(21)28)23-30-19(2,3)20(4,5)31-23;1-2-29-17(27)10-19(11-20(22,23)24)8-7-12-9-13(3-4-14(12)18(19)28)15-5-6-16(21)26-25-15;1-2;/h4-9,12,14H,3,10-11,13,15H2,1-2H3,(H,31,33);2-7,10,12H,8-9,11,13H2,1H3,(H,29,31)(H,32,33);7-8,11H,6,9-10,12-13H2,1-5H3;3-6,9H,2,7-8,10-11H2,1H3;1-2H3;1H4
InChIKeyIANOBTNIPPRNBA-UHFFFAOYSA-N
XLogP21.34
TPSA330.12 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds23
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001926.61
LogP ≤ 521.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid with MolForge

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Related Compounds

Ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
CID 160033703
5-bromo-N-(6-methyl-3-pyridinyl)pyrazin-2-amine;ethane;ethyl 2-[6-[5-[(6-methyl-3-pyridinyl)amino]pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;6-methylpyridin-3-amine;2-[6-[5-[(6-methyl-3-pyridinyl)amino]pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
CID 160636250
1-(5-Bromopyrazin-2-yl)-3-(3,4-difluorophenyl)urea;1,2-difluoro-4-isocyanatobenzene;2-[6-[5-[(3,4-difluorophenyl)carbamoylamino]pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid;ethane;ethyl 2-[6-[5-[(3,4-difluorophenyl)carbamoylamino]pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-methyl-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate
CID 160916981
5-Bromopyrazin-2-amine;1-(5-bromopyrazin-2-yl)-3-cyclohexylurea;2-[6-[5-(cyclohexylcarbamoylamino)pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid;ethyl 2-[6-[5-(cyclohexylcarbamoylamino)pyrazin-2-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate
CID 161131027
Ethane;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid
CID 162247719

Frequently Asked Questions

What is the IUPAC name of ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid?
The IUPAC name of ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid (CID 158642245) is ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid.
What is the SMILES notation for ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid?
The canonical SMILES for ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid is C.CC.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Br)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(-c3ccc(Nc4ccc(C)nc4)nn3)ccc2C1=O.CCOC(=O)CC1(CC(F)(F)F)CCc2cc(B3OC(C)(C)C(C)(C)O3)ccc2C1=O.Cc1ccc(Nc2ccc(-c3ccc4c(c3)CCC(CC(=O)O)(CC(F)(F)F)C4=O)nn2)cn1.
What is the InChIKey of ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid?
The InChIKey is IANOBTNIPPRNBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25F3N4O3.C24H21F3N4O3.C22H28BF3O5.C20H18BrF3N2O3.C2H6.CH4/c1-3-36-23(34)13-25(15-26(27,28)29)11-10-17-12-18(5-7-20(17)24(25)35)21-8-9-22(33-32-21)31-19-6-4-16(2)30-14-19;1-14-2-4-17(12-28-14)29-20-7-6-19(30-31-20)16-3-5-18-15(10-16)8-9-23(22(18)34,11-21(32)33)13-24(25,26)27;1-6-29-17(27)12-21(13-22(24,25)26)10-9-14-11-15(7-8-16(14)18(21)28)23-30-19(2,3)20(4,5)31-23;1-2-29-17(27)10-19(11-20(22,23)24)8-7-12-9-13(3-4-14(12)18(19)28)15-5-6-16(21)26-25-15;1-2;/h4-9,12,14H,3,10-11,13,15H2,1-2H3,(H,31,33);2-7,10,12H,8-9,11,13H2,1H3,(H,29,31)(H,32,33);7-8,11H,6,9-10,12-13H2,1-5H3;3-6,9H,2,7-8,10-11H2,1H3;1-2H3;1H4.
What are the key properties of ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid?
ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid has a molecular weight of 1926.61 g/mol, XLogP of 21.34, 23 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethyl 2-[6-(6-bromopyridazin-3-yl)-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;ethyl 2-[1-oxo-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetate;methane;2-[6-[6-[(6-methyl-3-pyridinyl)amino]pyridazin-3-yl]-1-oxo-2-(2,2,2-trifluoroethyl)-3,4-dihydronaphthalen-2-yl]acetic acid is sourced from PubChem (CID 158642245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).