13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile

C116H73Cl2F4N19O12 — CID 159221717

IUPAC13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile
SMILESCOc1cncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)c1.COc1ncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4Cl)c2=O)-c2ncccc2OC3)cn1.O=c1c(-c2ccccc2Cl)cc2c(n1-c1cccnc1)COc1cccnc1-2
InChIInChI=1S/C24H15FN4O3.C24H15FN4O2.C23H15ClFN3O2.C23H14FN5O3.C22H14ClN3O2/c1-31-15-8-14(11-27-12-15)29-21-13-32-22-6-3-7-28-23(22)18(21)9-17(24(29)30)16-4-2-5-20(25)19(16)10-26;1-14-7-8-15(12-28-14)29-21-13-31-22-6-3-9-27-23(22)18(21)10-17(24(29)30)16-4-2-5-20(25)19(16)11-26;1-13-7-8-14(11-27-13)28-19-12-30-20-6-3-9-26-22(20)17(19)10-16(23(28)29)15-4-2-5-18(25)21(15)24;1-31-23-27-10-13(11-28-23)29-19-12-32-20-6-3-7-26-21(20)16(19)8-15(22(29)30)14-4-2-5-18(24)17(14)9-25;23-18-7-2-1-6-15(18)16-11-17-19(13-28-20-8-4-10-25-21(17)20)26(22(16)27)14-5-3-9-24-12-14/h2-9,11-12H,13H2,1H3;2-10,12H,13H2,1H3;2-11H,12H2,1H3;2-8,10-11H,12H2,1H3;1-12H,13H2
InChIKeyKRTUXQHQDFSBNI-UHFFFAOYSA-N
MW2071.88 g/mol
LogP20.78
Rot. Bonds12

About 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile

13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile (PubChem CID 159221717) has the molecular formula C116H73Cl2F4N19O12 and a molecular weight of 2071.88 g/mol. Its IUPAC name is 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile.

Molecular Properties

Compound Name13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile
PubChem CID159221717
Molecular FormulaC116H73Cl2F4N19O12
Molecular Weight2071.88 g/mol
Exact Mass2069.50
IUPAC Name13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile
SMILESCOc1cncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)c1.COc1ncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4Cl)c2=O)-c2ncccc2OC3)cn1.O=c1c(-c2ccccc2Cl)cc2c(n1-c1cccnc1)COc1cccnc1-2
InChIInChI=1S/C24H15FN4O3.C24H15FN4O2.C23H15ClFN3O2.C23H14FN5O3.C22H14ClN3O2/c1-31-15-8-14(11-27-12-15)29-21-13-32-22-6-3-7-28-23(22)18(21)9-17(24(29)30)16-4-2-5-20(25)19(16)10-26;1-14-7-8-15(12-28-14)29-21-13-31-22-6-3-9-27-23(22)18(21)10-17(24(29)30)16-4-2-5-20(25)19(16)11-26;1-13-7-8-14(11-27-13)28-19-12-30-20-6-3-9-26-22(20)17(19)10-16(23(28)29)15-4-2-5-18(25)21(15)24;1-31-23-27-10-13(11-28-23)29-19-12-32-20-6-3-7-26-21(20)16(19)8-15(22(29)30)14-4-2-5-18(24)17(14)9-25;23-18-7-2-1-6-15(18)16-11-17-19(13-28-20-8-4-10-25-21(17)20)26(22(16)27)14-5-3-9-24-12-14/h2-9,11-12H,13H2,1H3;2-10,12H,13H2,1H3;2-11H,12H2,1H3;2-8,10-11H,12H2,1H3;1-12H,13H2
InChIKeyKRTUXQHQDFSBNI-UHFFFAOYSA-N
XLogP20.78
TPSA387.77 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds12
Heavy Atoms153
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002071.88
LogP ≤ 520.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Analyze 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile?
The IUPAC name of 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile (CID 159221717) is 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile.
What is the SMILES notation for 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile?
The canonical SMILES for 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile is COc1cncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)c1.COc1ncc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4C#N)c2=O)-c2ncccc2OC3)cn1.Cc1ccc(-n2c3c(cc(-c4cccc(F)c4Cl)c2=O)-c2ncccc2OC3)cn1.O=c1c(-c2ccccc2Cl)cc2c(n1-c1cccnc1)COc1cccnc1-2.
What is the InChIKey of 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile?
The InChIKey is KRTUXQHQDFSBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15FN4O3.C24H15FN4O2.C23H15ClFN3O2.C23H14FN5O3.C22H14ClN3O2/c1-31-15-8-14(11-27-12-15)29-21-13-32-22-6-3-7-28-23(22)18(21)9-17(24(29)30)16-4-2-5-20(25)19(16)10-26;1-14-7-8-15(12-28-14)29-21-13-31-22-6-3-9-27-23(22)18(21)10-17(24(29)30)16-4-2-5-20(25)19(16)11-26;1-13-7-8-14(11-27-13)28-19-12-30-20-6-3-9-26-22(20)17(19)10-16(23(28)29)15-4-2-5-18(25)21(15)24;1-31-23-27-10-13(11-28-23)29-19-12-32-20-6-3-7-26-21(20)16(19)8-15(22(29)30)14-4-2-5-18(24)17(14)9-25;23-18-7-2-1-6-15(18)16-11-17-19(13-28-20-8-4-10-25-21(17)20)26(22(16)27)14-5-3-9-24-12-14/h2-9,11-12H,13H2,1H3;2-10,12H,13H2,1H3;2-11H,12H2,1H3;2-8,10-11H,12H2,1H3;1-12H,13H2.
What are the key properties of 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile?
13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile has a molecular weight of 2071.88 g/mol, XLogP of 20.78, 12 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 13-(2-chloro-3-fluorophenyl)-11-(6-methyl-3-pyridinyl)-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;13-(2-chlorophenyl)-11-pyridin-3-yl-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-12-one;2-fluoro-6-[11-(5-methoxy-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(2-methoxypyrimidin-5-yl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile;2-fluoro-6-[11-(6-methyl-3-pyridinyl)-12-oxo-8-oxa-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5,13-pentaen-13-yl]benzonitrile is sourced from PubChem (CID 159221717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).