(2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione

C135H118F10N16O20S2 — CID 164982169

About (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione

(2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione (PubChem CID 164982169) has the molecular formula C135H118F10N16O20S2 and a molecular weight of 2538.63 g/mol. Its IUPAC name is (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione.

Molecular Properties

• Compound Name: (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione
• PubChem CID: 164982169
• Molecular Formula: C135H118F10N16O20S2
• Molecular Weight: 2538.63 g/mol
• Exact Mass: 2536.80
• IUPAC Name: (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione
• SMILES: CC(C)c1ccccc1[C@@H]1c2ccc(F)c(F)c2OC/C=C\CN2CN1n1ccc(=O)c(O)c1C2=O.CC(C)c1ccccc1[C@H]1c2ccc(F)c(F)c2OC/C=C\CN2CN1n1ccc(=O)c(O)c1C2=O.CC[C@H]1/C=C/COc2c(ccc(F)c2F)[C@@H](c2ccccn2)N2CN1C(=O)c1c(O)c(=O)ccn12.O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C\COc3cc(F)c(F)c4c3[C@@H]2c2ccccc2SC4)CCC1.O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C\COc3cc(F)c(F)c4c3[C@H]2c2ccccc2SC4)CCC1
• InChI: InChI=1S/2C28H23F2N3O4S.2C27H25F2N3O4.C25H22F2N4O4/c2*29-18-13-20-22-17(23(18)30)14-38-21-6-2-1-5-16(21)24(22)33-15-31(28(8-3-9-28)10-4-12-37-20)27(36)25-26(35)19(34)7-11-32(25)33;2*1-16(2)17-7-3-4-8-18(17)23-19-9-10-20(28)22(29)26(19)36-14-6-5-12-30-15-32(23)31-13-11-21(33)25(34)24(31)27(30)35;1-2-15-6-5-13-35-24-16(8-9-17(26)20(24)27)21(18-7-3-4-11-28-18)31-14-29(15)25(34)22-23(33)19(32)10-12-30(22)31/h2*1-2,4-7,10-11,13,24,35H,3,8-9,12,14-15H2;2*3-11,13,16,23,34H,12,14-15H2,1-2H3;3-12,15,21,33H,2,13-14H2,1H3/b2*10-4-;2*6-5-;6-5+/t2*24-;2*23-;15-,21-/m10100/s1
• InChIKey: FQNJFZLVMNPDFD-HCKRCUOSSA-N
• XLogP: 20.09
• TPSA: 387.94 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 33
• Rotatable Bonds: 6
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2538.63
LogP ≤ 5	20.09
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione?

The IUPAC name of (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione (CID 164982169) is (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione.

What is the SMILES notation for (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione?

The canonical SMILES for (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione is CC(C)c1ccccc1[C@@H]1c2ccc(F)c(F)c2OC/C=C\CN2CN1n1ccc(=O)c(O)c1C2=O.CC(C)c1ccccc1[C@H]1c2ccc(F)c(F)c2OC/C=C\CN2CN1n1ccc(=O)c(O)c1C2=O.CC[C@H]1/C=C/COc2c(ccc(F)c2F)[C@@H](c2ccccn2)N2CN1C(=O)c1c(O)c(=O)ccn12.O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C\COc3cc(F)c(F)c4c3[C@@H]2c2ccccc2SC4)CCC1.O=C1c2c(O)c(=O)ccn2N2CN1C1(/C=C\COc3cc(F)c(F)c4c3[C@H]2c2ccccc2SC4)CCC1.

What is the InChIKey of (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione?

The InChIKey is FQNJFZLVMNPDFD-HCKRCUOSSA-N. The full InChI is InChI=1S/2C28H23F2N3O4S.2C27H25F2N3O4.C25H22F2N4O4/c2*29-18-13-20-22-17(23(18)30)14-38-21-6-2-1-5-16(21)24(22)33-15-31(28(8-3-9-28)10-4-12-37-20)27(36)25-26(35)19(34)7-11-32(25)33;2*1-16(2)17-7-3-4-8-18(17)23-19-9-10-20(28)22(29)26(19)36-14-6-5-12-30-15-32(23)31-13-11-21(33)25(34)24(31)27(30)35;1-2-15-6-5-13-35-24-16(8-9-17(26)20(24)27)21(18-7-3-4-11-28-18)31-14-29(15)25(34)22-23(33)19(32)10-12-30(22)31/h2*1-2,4-7,10-11,13,24,35H,3,8-9,12,14-15H2;2*3-11,13,16,23,34H,12,14-15H2,1-2H3;3-12,15,21,33H,2,13-14H2,1H3/b2*10-4-;2*6-5-;6-5+/t2*24-;2*23-;15-,21-/m10100/s1.

What are the key properties of (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione?

(2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione has a molecular weight of 2538.63 g/mol, XLogP of 20.09, 6 rotatable bonds, 5 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(2S,11Z)-6,7-difluoro-17-hydroxy-2-(2-propan-2-ylphenyl)-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione;(1R,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(1S,12E)-18,19-difluoro-7-hydroxyspiro[15-oxa-22-thia-2,3,10-triazahexacyclo[14.12.1.12,10.03,8.020,29.023,28]triaconta-4,7,12,16,18,20(29),23,25,27-nonaene-11,1'-cyclobutane]-6,9-dione;(2S,11E,13S)-13-ethyl-6,7-difluoro-17-hydroxy-2-pyridin-2-yl-9-oxa-1,14,21-triazatetracyclo[12.7.1.03,8.016,21]docosa-3(8),4,6,11,16,19-hexaene-15,18-dione is sourced from PubChem (CID 164982169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).