10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile

C127H92F3N25O21S10 — CID 158064111

About 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile

10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile (PubChem CID 158064111) has the molecular formula C127H92F3N25O21S10 and a molecular weight of 2681.95 g/mol. Its IUPAC name is 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile.

Molecular Properties

• Compound Name: 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile
• PubChem CID: 158064111
• Molecular Formula: C127H92F3N25O21S10
• Molecular Weight: 2681.95 g/mol
• Exact Mass: 2679.41
• IUPAC Name: 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile
• SMILES: COc1ncc2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)CCc1ccc(o1)-c1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)CCc1ccc(s1)-c1c(C#N)cnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCCNc1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(F)cc(c1)-c1ncnc3cc-2sc13
• InChI: InChI=1S/C27H18F2N6O4S.C27H18N4O4S3.C26H18FN5O4S2.C25H18N4O5S2.C22H20N6O4S2/c1-39-27-23-7-16(13-33-27)21-2-3-22-25(34-21)17(4-5-31-22)15-6-14(10-30-12-15)11-32-26(36)18-8-24(40(37,38)35-23)20(29)9-19(18)28;1-35-27-21-10-16(13-30-27)24-11-20-26(37-24)25(17(12-28)14-29-20)23-8-6-18(36-23)5-7-22(32)15-3-2-4-19(9-15)38(33,34)31-21;1-36-26-21-9-17(12-29-26)22-10-20-24(37-22)23(31-13-30-20)16-5-14(6-18(27)7-16)11-28-25(33)15-3-2-4-19(8-15)38(34,35)32-21;1-33-25-19-10-15(12-26-25)22-11-18-24(35-22)23(28-13-27-18)21-8-6-16(34-21)5-7-20(30)14-3-2-4-17(9-14)36(31,32)29-19;1-32-22-17-9-14(11-25-22)18-10-16-19(33-18)20(27-12-26-16)23-6-3-7-24-21(29)13-4-2-5-15(8-13)34(30,31)28-17/h2-10,12-13,35H,11H2,1H3,(H,32,36);2-4,6,8-11,13-14,31H,5,7H2,1H3;2-10,12-13,32H,11H2,1H3,(H,28,33);2-4,6,8-13,29H,5,7H2,1H3;2,4-5,8-12,28H,3,6-7H2,1H3,(H,24,29)(H,23,26,27)
• InChIKey: FLAARBOQCRPBGI-UHFFFAOYSA-N
• XLogP: 22.65
• TPSA: 640.75 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 43
• Rotatable Bonds: 5
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2681.95
LogP ≤ 5	22.65
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	43

Frequently Asked Questions

What is the IUPAC name of 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile?

The IUPAC name of 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile (CID 158064111) is 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile.

What is the SMILES notation for 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile?

The canonical SMILES for 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile is COc1ncc2cc1NS(=O)(=O)c1cc(c(F)cc1F)C(=O)NCc1cncc(c1)-c1ccnc3ccc-2nc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)CCc1ccc(o1)-c1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)CCc1ccc(s1)-c1c(C#N)cnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCCCNc1ncnc3cc-2sc13.COc1ncc2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1cc(F)cc(c1)-c1ncnc3cc-2sc13.

What is the InChIKey of 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile?

The InChIKey is FLAARBOQCRPBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H18F2N6O4S.C27H18N4O4S3.C26H18FN5O4S2.C25H18N4O5S2.C22H20N6O4S2/c1-39-27-23-7-16(13-33-27)21-2-3-22-25(34-21)17(4-5-31-22)15-6-14(10-30-12-15)11-32-26(36)18-8-24(40(37,38)35-23)20(29)9-19(18)28;1-35-27-21-10-16(13-30-27)24-11-20-26(37-24)25(17(12-28)14-29-20)23-8-6-18(36-23)5-7-22(32)15-3-2-4-19(9-15)38(33,34)31-21;1-36-26-21-9-17(12-29-26)22-10-20-24(37-22)23(31-13-30-20)16-5-14(6-18(27)7-16)11-28-25(33)15-3-2-4-19(8-15)38(34,35)32-21;1-33-25-19-10-15(12-26-25)22-11-18-24(35-22)23(28-13-27-18)21-8-6-16(34-21)5-7-20(30)14-3-2-4-17(9-14)36(31,32)29-19;1-32-22-17-9-14(11-25-22)18-10-16-19(33-18)20(27-12-26-16)23-6-3-7-24-21(29)13-4-2-5-15(8-13)34(30,31)28-17/h2-10,12-13,35H,11H2,1H3,(H,32,36);2-4,6,8-11,13-14,31H,5,7H2,1H3;2-10,12-13,32H,11H2,1H3,(H,28,33);2-4,6,8-13,29H,5,7H2,1H3;2,4-5,8-12,28H,3,6-7H2,1H3,(H,24,29)(H,23,26,27).

What are the key properties of 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile?

10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile has a molecular weight of 2681.95 g/mol, XLogP of 22.65, 5 rotatable bonds, 9 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for 10,12-difluoro-5-methoxy-8,8-dioxo-8λ6-thia-4,7,15,19,25,29-hexazahexacyclo[20.6.2.12,6.19,13.117,21.026,30]tritriaconta-1(29),2(33),3,5,9,11,13(32),17(31),18,20,22(30),23,25,27-tetradecaen-14-one;12-fluoro-26-methoxy-23,23-dioxo-3,23λ6-dithia-6,8,16,24,27-pentazahexacyclo[23.3.1.12,5.110,14.118,22.04,9]dotriaconta-1(29),2(32),4,6,8,10,12,14(31),18(30),19,21,25,27-tridecaen-17-one;24-methoxy-21,21-dioxo-3,21λ6-dithia-6,8,10,14,22,25-hexazapentacyclo[21.3.1.12,5.116,20.04,9]nonacosa-1(27),2(29),4,6,8,16(28),17,19,23,25-decaen-15-one;25-methoxy-22,22-dioxo-30-oxa-3,22λ6-dithia-6,8,23,26-tetrazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4,6,8,10,12,17(29),18,20,24,26-dodecaen-16-one;25-methoxy-16,22,22-trioxo-3,22λ6,30-trithia-6,23,26-triazahexacyclo[22.3.1.12,5.110,13.117,21.04,9]hentriaconta-1(28),2(31),4(9),5,7,10,12,17(29),18,20,24,26-dodecaene-8-carbonitrile is sourced from PubChem (CID 158064111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).