tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid

C116H105BCl5F8N27O15 — CID 167608968

About tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid

tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid (PubChem CID 167608968) has the molecular formula C116H105BCl5F8N27O15 and a molecular weight of 2457.35 g/mol. Its IUPAC name is tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid.

Molecular Properties

• Compound Name: tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid
• PubChem CID: 167608968
• Molecular Formula: C116H105BCl5F8N27O15
• Molecular Weight: 2457.35 g/mol
• Exact Mass: 2453.67
• IUPAC Name: tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid
• SMILES: C=CC(=O)N1CCN2c3nc(=O)n(-c4cncnc4C4CC4)c4nc(-c5cccc(F)c5F)c(Cl)c(c34)OC[C@H]2C1.Cc1ncnc(C2CC2)c1-n1c(=O)nc2c3c(c(Cl)c(-c4cccc(F)c4F)nc31)OC[C@H]1CN(C(=O)OC(C)(C)C)CCN21.Cc1ncnc(C2CC2)c1-n1c(=O)nc2c3c(c(Cl)c(Cl)nc31)OC[C@H]1CN(C(=O)OC(C)(C)C)CCN21.O=c1nc2c3c(c(Cl)c(-c4cccc(F)c4F)nc3n1-c1cncnc1C1CC1)OC[C@H]1CCCCN21.OB(O)c1cccc(F)c1F
• InChI: InChI=1S/C31H30ClF2N7O4.C28H22ClF2N7O3.C26H21ClF2N6O2.C25H27Cl2N7O4.C6H5BF2O2/c1-15-25(23(16-8-9-16)36-14-35-15)41-28-20-26(21(32)24(37-28)18-6-5-7-19(33)22(18)34)44-13-17-12-39(30(43)45-31(2,3)4)10-11-40(17)27(20)38-29(41)42;1-2-19(39)36-8-9-37-15(11-36)12-41-25-20-26(37)35-28(40)38(18-10-32-13-33-23(18)14-6-7-14)27(20)34-24(21(25)29)16-4-3-5-17(30)22(16)31;27-19-22(15-5-3-6-16(28)20(15)29)32-25-18-23(19)37-11-14-4-1-2-9-34(14)24(18)33-26(36)35(25)17-10-30-12-31-21(17)13-7-8-13;1-12-18(17(13-5-6-13)29-11-28-12)34-22-15-19(16(26)20(27)30-22)37-10-14-9-32(24(36)38-25(2,3)4)7-8-33(14)21(15)31-23(34)35;8-5-3-1-2-4(6(5)9)7(10)11/h5-7,14,16-17H,8-13H2,1-4H3;2-5,10,13-15H,1,6-9,11-12H2;3,5-6,10,12-14H,1-2,4,7-9,11H2;11,13-14H,5-10H2,1-4H3;1-3,10-11H/t17-;15-;2*14-;/m1111./s1
• InChIKey: KTULWISTYZXWQP-PYMXPMFKSA-N
• XLogP: 17.14
• TPSA: 463.97 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 39
• Rotatable Bonds: 13
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2457.35
LogP ≤ 5	17.14
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid?

The IUPAC name of tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid (CID 167608968) is tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid.

What is the SMILES notation for tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid?

The canonical SMILES for tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid is C=CC(=O)N1CCN2c3nc(=O)n(-c4cncnc4C4CC4)c4nc(-c5cccc(F)c5F)c(Cl)c(c34)OC[C@H]2C1.Cc1ncnc(C2CC2)c1-n1c(=O)nc2c3c(c(Cl)c(-c4cccc(F)c4F)nc31)OC[C@H]1CN(C(=O)OC(C)(C)C)CCN21.Cc1ncnc(C2CC2)c1-n1c(=O)nc2c3c(c(Cl)c(Cl)nc31)OC[C@H]1CN(C(=O)OC(C)(C)C)CCN21.O=c1nc2c3c(c(Cl)c(-c4cccc(F)c4F)nc3n1-c1cncnc1C1CC1)OC[C@H]1CCCCN21.OB(O)c1cccc(F)c1F.

What is the InChIKey of tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid?

The InChIKey is KTULWISTYZXWQP-PYMXPMFKSA-N. The full InChI is InChI=1S/C31H30ClF2N7O4.C28H22ClF2N7O3.C26H21ClF2N6O2.C25H27Cl2N7O4.C6H5BF2O2/c1-15-25(23(16-8-9-16)36-14-35-15)41-28-20-26(21(32)24(37-28)18-6-5-7-19(33)22(18)34)44-13-17-12-39(30(43)45-31(2,3)4)10-11-40(17)27(20)38-29(41)42;1-2-19(39)36-8-9-37-15(11-36)12-41-25-20-26(37)35-28(40)38(18-10-32-13-33-23(18)14-6-7-14)27(20)34-24(21(25)29)16-4-3-5-17(30)22(16)31;27-19-22(15-5-3-6-16(28)20(15)29)32-25-18-23(19)37-11-14-4-1-2-9-34(14)24(18)33-26(36)35(25)17-10-30-12-31-21(17)13-7-8-13;1-12-18(17(13-5-6-13)29-11-28-12)34-22-15-19(16(26)20(27)30-22)37-10-14-9-32(24(36)38-25(2,3)4)7-8-33(14)21(15)31-23(34)35;8-5-3-1-2-4(6(5)9)7(10)11/h5-7,14,16-17H,8-13H2,1-4H3;2-5,10,13-15H,1,6-9,11-12H2;3,5-6,10,12-14H,1-2,4,7-9,11H2;11,13-14H,5-10H2,1-4H3;1-3,10-11H/t17-;15-;2*14-;/m1111./s1.

What are the key properties of tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid?

tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid has a molecular weight of 2457.35 g/mol, XLogP of 17.14, 13 rotatable bonds, 2 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl (7R)-11-chloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;tert-butyl (7R)-11,12-dichloro-15-(4-cyclopropyl-6-methylpyrimidin-5-yl)-16-oxo-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraene-5-carboxylate;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-9-oxa-2,13,15,17-tetrazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(7R)-11-chloro-15-(4-cyclopropylpyrimidin-5-yl)-12-(2,3-difluorophenyl)-5-prop-2-enoyl-9-oxa-2,5,13,15,17-pentazatetracyclo[8.7.1.02,7.014,18]octadeca-1(17),10(18),11,13-tetraen-16-one;(2,3-difluorophenyl)boronic acid is sourced from PubChem (CID 167608968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).