1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone

C85H74Cl2F9N9O12S — CID 165078093

IUPAC1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone
SMILESCC(=O)c1cc(-c2ccc(F)cc2)c2c(n1)O[C@@H](COC(F)F)CC2.CC(=O)c1cc(-c2cnc(C)s2)c2c(n1)O[C@H](COC(F)F)CC2.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@H]1CC[C@@H](C2)O1.CC(=O)c1cc(-c2ncc(F)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1
InChIInChI=1S/C18H16F3NO3.2C17H14ClFN2O2.C17H14F2N2O2.C16H16F2N2O3S/c1-10(23)16-8-15(11-2-4-12(19)5-3-11)14-7-6-13(9-24-18(20)21)25-17(14)22-16;3*1-8(22)14-6-12(16-13(19)4-9(18)7-20-16)11-5-10-2-3-15(23-10)17(11)21-14;1-8(21)13-5-12(14-6-19-9(2)24-14)11-4-3-10(7-22-16(17)18)23-15(11)20-13/h2-5,8,13,18H,6-7,9H2,1H3;3*4,6-7,10,15H,2-3,5H2,1H3;5-6,10,16H,3-4,7H2,1-2H3/t13-;3*10-,15+;10-/m11010/s1
InChIKeyUQRRLKWQUMHZHH-GVGLSELDSA-N
MW1687.53 g/mol
LogP18.90
Rot. Bonds16

About 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone

1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone (PubChem CID 165078093) has the molecular formula C85H74Cl2F9N9O12S and a molecular weight of 1687.53 g/mol. Its IUPAC name is 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone.

Molecular Properties

Compound Name1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone
PubChem CID165078093
Molecular FormulaC85H74Cl2F9N9O12S
Molecular Weight1687.53 g/mol
Exact Mass1685.44
IUPAC Name1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone
SMILESCC(=O)c1cc(-c2ccc(F)cc2)c2c(n1)O[C@@H](COC(F)F)CC2.CC(=O)c1cc(-c2cnc(C)s2)c2c(n1)O[C@H](COC(F)F)CC2.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@H]1CC[C@@H](C2)O1.CC(=O)c1cc(-c2ncc(F)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1
InChIInChI=1S/C18H16F3NO3.2C17H14ClFN2O2.C17H14F2N2O2.C16H16F2N2O3S/c1-10(23)16-8-15(11-2-4-12(19)5-3-11)14-7-6-13(9-24-18(20)21)25-17(14)22-16;3*1-8(22)14-6-12(16-13(19)4-9(18)7-20-16)11-5-10-2-3-15(23-10)17(11)21-14;1-8(21)13-5-12(14-6-19-9(2)24-14)11-4-3-10(7-22-16(17)18)23-15(11)20-13/h2-5,8,13,18H,6-7,9H2,1H3;3*4,6-7,10,15H,2-3,5H2,1H3;5-6,10,16H,3-4,7H2,1-2H3/t13-;3*10-,15+;10-/m11010/s1
InChIKeyUQRRLKWQUMHZHH-GVGLSELDSA-N
XLogP18.90
TPSA265.97 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds16
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001687.53
LogP ≤ 518.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone with MolForge

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Launch Full Analysis

Related Compounds

(2R)-2-(difluoromethoxymethyl)-5-[2-(difluoromethyl)-1,3-thiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R,3R)-2-(difluoromethoxymethyl)-5-(2,4-difluorophenyl)-3-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-2-(difluoromethyl)-5-(2,4-difluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-2-(difluoromethyl)-5-(2,4-difluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-5-(2,4-difluorophenyl)-2-(2,2,2-trifluoroethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
CID 160443587
CID 158544920
CID 158544920
(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-4-carboxamide;(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-4-carboxamide;(2R)-5-(2,4-difluorophenyl)-2-(hydroxymethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-5-(2,4-difluorophenyl)-2-(hydroxymethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S,3R)-5-(2,4-difluorophenyl)-2-(hydroxymethyl)-3-methyl-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-4-carboxamide
CID 159243279
(2S)-2-(difluoromethoxymethyl)-5-[2-(difluoromethyl)-1,3-thiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-5-(2,4-difluorophenyl)-2-(fluoromethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-5-(2,4-difluorophenyl)-2-(fluoromethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
CID 160242022
(2S)-2-(difluoromethoxymethyl)-5-(2,4-difluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
CID 161065883
(2S)-2-(difluoromethoxymethyl)-5-[2-(difluoromethyl)-1,3-thiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-2-(difluoromethoxymethyl)-5-[2-(difluoromethyl)-1,3-thiazol-5-yl]-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-5-(2,4-difluorophenyl)-2-(fluoromethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2S)-5-(2,4-difluorophenyl)-2-(methoxymethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide;(2R)-5-(2,4-difluorophenyl)-2-(methoxymethyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine-7-carboxamide
CID 161496265

Frequently Asked Questions

What is the IUPAC name of 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone?
The IUPAC name of 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone (CID 165078093) is 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone.
What is the SMILES notation for 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone?
The canonical SMILES for 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone is CC(=O)c1cc(-c2ccc(F)cc2)c2c(n1)O[C@@H](COC(F)F)CC2.CC(=O)c1cc(-c2cnc(C)s2)c2c(n1)O[C@H](COC(F)F)CC2.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1.CC(=O)c1cc(-c2ncc(Cl)cc2F)c2c(n1)[C@H]1CC[C@@H](C2)O1.CC(=O)c1cc(-c2ncc(F)cc2F)c2c(n1)[C@@H]1CC[C@H](C2)O1.
What is the InChIKey of 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone?
The InChIKey is UQRRLKWQUMHZHH-GVGLSELDSA-N. The full InChI is InChI=1S/C18H16F3NO3.2C17H14ClFN2O2.C17H14F2N2O2.C16H16F2N2O3S/c1-10(23)16-8-15(11-2-4-12(19)5-3-11)14-7-6-13(9-24-18(20)21)25-17(14)22-16;3*1-8(22)14-6-12(16-13(19)4-9(18)7-20-16)11-5-10-2-3-15(23-10)17(11)21-14;1-8(21)13-5-12(14-6-19-9(2)24-14)11-4-3-10(7-22-16(17)18)23-15(11)20-13/h2-5,8,13,18H,6-7,9H2,1H3;3*4,6-7,10,15H,2-3,5H2,1H3;5-6,10,16H,3-4,7H2,1-2H3/t13-;3*10-,15+;10-/m11010/s1.
What are the key properties of 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone?
1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone has a molecular weight of 1687.53 g/mol, XLogP of 18.90, 16 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S,9R)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(1R,9S)-6-(5-chloro-3-fluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone;1-[(2R)-2-(difluoromethoxymethyl)-5-(4-fluorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(2S)-2-(difluoromethoxymethyl)-5-(2-methyl-1,3-thiazol-5-yl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-7-yl]ethanone;1-[(1S,9R)-6-(3,5-difluoro-2-pyridinyl)-12-oxa-3-azatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-4-yl]ethanone is sourced from PubChem (CID 165078093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).