2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane

C173H187Cl4N27O26S4 — CID 162030493

About 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane

2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane (PubChem CID 162030493) has the molecular formula C173H187Cl4N27O26S4 and a molecular weight of 3330.64 g/mol. Its IUPAC name is 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane.

Molecular Properties

• Compound Name: 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane
• PubChem CID: 162030493
• Molecular Formula: C173H187Cl4N27O26S4
• Molecular Weight: 3330.64 g/mol
• Exact Mass: 3326.18
• IUPAC Name: 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane
• SMILES: C.C=C1CCC(N2C(=O)c3ccc(C(=O)NCCCCCCCC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)cc3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCCCCCCNC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCCNC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCOCCOCCOCCCCC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1
• InChI: InChI=1S/C47H53ClN6O9S.C44H48ClN7O6S.C41H42ClN7O5S.C40H40ClN7O6S.CH4/c1-28-14-19-38(44(57)49-28)54-45(58)36-12-9-13-39(41(36)46(54)59)63-27-35(56)11-6-8-21-61-23-25-62-24-22-60-20-7-5-10-34(55)26-37-43-52-51-31(4)53(43)47-40(29(2)30(3)64-47)42(50-37)32-15-17-33(48)18-16-32;1-25-16-21-34(41(55)47-25)52-42(56)32-14-12-15-35(38(32)43(52)57)58-24-31(53)13-10-8-6-5-7-9-11-22-46-36(54)23-33-40-50-49-28(4)51(40)44-37(26(2)27(3)59-44)39(48-33)29-17-19-30(45)20-18-29;1-22-11-18-33(38(52)44-22)49-39(53)30-17-14-27(20-31(30)40(49)54)37(51)43-19-9-7-5-6-8-10-29(50)21-32-36-47-46-25(4)48(36)41-34(23(2)24(3)55-41)35(45-32)26-12-15-28(42)16-13-26;1-21-12-17-30(37(51)43-21)48-38(52)28-10-8-11-31(34(28)39(48)53)54-20-27(49)9-6-5-7-18-42-32(50)19-29-36-46-45-24(4)47(36)40-33(22(2)23(3)55-40)35(44-29)25-13-15-26(41)16-14-25;/h9,12-13,15-18,37-38H,1,5-8,10-11,14,19-27H2,2-4H3,(H,49,57);12,14-15,17-20,33-34H,1,5-11,13,16,21-24H2,2-4H3,(H,46,54)(H,47,55);12-17,20,32-33H,1,5-11,18-19,21H2,2-4H3,(H,43,51)(H,44,52);8,10-11,13-16,29-30H,1,5-7,9,12,17-20H2,2-4H3,(H,42,50)(H,43,51);1H4/t37-,38?;33-,34?;32-,33?;29-,30?;/m0000./s1
• InChIKey: YVYMVYWFANMCNC-HEGJJPGUSA-N
• XLogP: 28.11
• TPSA: 666.23 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 46
• Rotatable Bonds: 66
• Heavy Atoms: 234
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3330.64
LogP ≤ 5	28.11
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane?

The IUPAC name of 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane (CID 162030493) is 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane.

What is the SMILES notation for 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane?

The canonical SMILES for 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane is C.C=C1CCC(N2C(=O)c3ccc(C(=O)NCCCCCCCC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)cc3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCCCCCCNC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCCNC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1.C=C1CCC(N2C(=O)c3cccc(OCC(=O)CCCCOCCOCCOCCCCC(=O)C[C@@H]4N=C(c5ccc(Cl)cc5)c5c(sc(C)c5C)-n5c(C)nnc54)c3C2=O)C(=O)N1.

What is the InChIKey of 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane?

The InChIKey is YVYMVYWFANMCNC-HEGJJPGUSA-N. The full InChI is InChI=1S/C47H53ClN6O9S.C44H48ClN7O6S.C41H42ClN7O5S.C40H40ClN7O6S.CH4/c1-28-14-19-38(44(57)49-28)54-45(58)36-12-9-13-39(41(36)46(54)59)63-27-35(56)11-6-8-21-61-23-25-62-24-22-60-20-7-5-10-34(55)26-37-43-52-51-31(4)53(43)47-40(29(2)30(3)64-47)42(50-37)32-15-17-33(48)18-16-32;1-25-16-21-34(41(55)47-25)52-42(56)32-14-12-15-35(38(32)43(52)57)58-24-31(53)13-10-8-6-5-7-9-11-22-46-36(54)23-33-40-50-49-28(4)51(40)44-37(26(2)27(3)59-44)39(48-33)29-17-19-30(45)20-18-29;1-22-11-18-33(38(52)44-22)49-39(53)30-17-14-27(20-31(30)40(49)54)37(51)43-19-9-7-5-6-8-10-29(50)21-32-36-47-46-25(4)48(36)41-34(23(2)24(3)55-41)35(45-32)26-12-15-28(42)16-13-26;1-21-12-17-30(37(51)43-21)48-38(52)28-10-8-11-31(34(28)39(48)53)54-20-27(49)9-6-5-7-18-42-32(50)19-29-36-46-45-24(4)47(36)40-33(22(2)23(3)55-40)35(44-29)25-13-15-26(41)16-14-25;/h9,12-13,15-18,37-38H,1,5-8,10-11,14,19-27H2,2-4H3,(H,49,57);12,14-15,17-20,33-34H,1,5-11,13,16,21-24H2,2-4H3,(H,46,54)(H,47,55);12-17,20,32-33H,1,5-11,18-19,21H2,2-4H3,(H,43,51)(H,44,52);8,10-11,13-16,29-30H,1,5-7,9,12,17-20H2,2-4H3,(H,42,50)(H,43,51);1H4/t37-,38?;33-,34?;32-,33?;29-,30?;/m0000./s1.

What are the key properties of 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane?

2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane has a molecular weight of 3330.64 g/mol, XLogP of 28.11, 66 rotatable bonds, 7 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[7-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-6-oxoheptyl]acetamide;2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-[11-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxy-10-oxoundecyl]acetamide;4-[6-[2-[2-[6-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-5-oxohexoxy]ethoxy]ethoxy]-2-oxohexoxy]-2-(6-methylidene-2-oxopiperidin-3-yl)isoindole-1,3-dione;N-[9-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-8-oxononyl]-2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindole-5-carboxamide;methane is sourced from PubChem (CID 162030493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).