2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene

C176H170BBr2F3N24O10 — CID 160915157

About 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene

2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene (PubChem CID 160915157) has the molecular formula C176H170BBr2F3N24O10 and a molecular weight of 3009.07 g/mol. Its IUPAC name is 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene.

Molecular Properties

• Compound Name: 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene
• PubChem CID: 160915157
• Molecular Formula: C176H170BBr2F3N24O10
• Molecular Weight: 3009.07 g/mol
• Exact Mass: 3005.19
• IUPAC Name: 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene
• SMILES: C.C.C.CC(C)(C)OC(=O)NC1(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2F)CCC1.Cc1ccccc1-c1cn2c(n1)-c1ccccc1Nc1ncccc1-2.Cc1ccccc1-c1nc2n(c1-c1ccc(C3(N)CCC3)c(F)c1)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1-c1nc2n(c1-c1ccc(C3(NC(=O)OC(C)(C)C)CCC3)c(F)c1)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1-c1nc2n(c1Br)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1C(=O)CBr.Cc1ccccc1C(=O)CN1C(=O)c2ccccc2Nc2ncccc21.O=C1Cc2cccnc2Nc2ccccc21
• InChI: InChI=1S/C36H34FN5O2.C31H26FN5.C21H31BFNO4.C21H15BrN4.C21H16N4.C21H17N3O2.C13H10N2O.C9H9BrO.3CH4/c1-22-11-5-6-12-24(22)30-31(42-29-15-9-20-38-32(29)39-28-14-8-7-13-25(28)33(42)40-30)23-16-17-26(27(37)21-23)36(18-10-19-36)41-34(43)44-35(2,3)4;1-19-8-2-3-9-21(19)27-28(20-13-14-23(24(32)18-20)31(33)15-7-16-31)37-26-12-6-17-34-29(26)35-25-11-5-4-10-22(25)30(37)36-27;1-18(2,3)26-17(25)24-21(11-8-12-21)15-10-9-14(13-16(15)23)22-27-19(4,5)20(6,7)28-22;1-13-7-2-3-8-14(13)18-19(22)26-17-11-6-12-23-20(17)24-16-10-5-4-9-15(16)21(26)25-18;1-14-7-2-3-8-15(14)18-13-25-19-11-6-12-22-20(19)23-17-10-5-4-9-16(17)21(25)24-18;1-14-7-2-3-8-15(14)19(25)13-24-18-11-6-12-22-20(18)23-17-10-5-4-9-16(17)21(24)26;16-12-8-9-4-3-7-14-13(9)15-11-6-2-1-5-10(11)12;1-7-4-2-3-5-8(7)9(11)6-10;;;/h5-9,11-17,20-21H,10,18-19H2,1-4H3,(H,38,39)(H,41,43);2-6,8-14,17-18H,7,15-16,33H2,1H3,(H,34,35);9-10,13H,8,11-12H2,1-7H3,(H,24,25);2-12H,1H3,(H,23,24);2-13H,1H3,(H,22,23);2-12H,13H2,1H3,(H,22,23);1-7H,8H2,(H,14,15);2-5H,6H2,1H3;3*1H4
• InChIKey: SRHOHFNAZIUALE-UHFFFAOYSA-N
• XLogP: 41.53
• TPSA: 413.46 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 31
• Rotatable Bonds: 17
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3009.07
LogP ≤ 5	41.53
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene?

The IUPAC name of 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene (CID 160915157) is 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene.

What is the SMILES notation for 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene?

The canonical SMILES for 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene is C.C.C.CC(C)(C)OC(=O)NC1(c2ccc(B3OC(C)(C)C(C)(C)O3)cc2F)CCC1.Cc1ccccc1-c1cn2c(n1)-c1ccccc1Nc1ncccc1-2.Cc1ccccc1-c1nc2n(c1-c1ccc(C3(N)CCC3)c(F)c1)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1-c1nc2n(c1-c1ccc(C3(NC(=O)OC(C)(C)C)CCC3)c(F)c1)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1-c1nc2n(c1Br)-c1cccnc1Nc1ccccc1-2.Cc1ccccc1C(=O)CBr.Cc1ccccc1C(=O)CN1C(=O)c2ccccc2Nc2ncccc21.O=C1Cc2cccnc2Nc2ccccc21.

What is the InChIKey of 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene?

The InChIKey is SRHOHFNAZIUALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H34FN5O2.C31H26FN5.C21H31BFNO4.C21H15BrN4.C21H16N4.C21H17N3O2.C13H10N2O.C9H9BrO.3CH4/c1-22-11-5-6-12-24(22)30-31(42-29-15-9-20-38-32(29)39-28-14-8-7-13-25(28)33(42)40-30)23-16-17-26(27(37)21-23)36(18-10-19-36)41-34(43)44-35(2,3)4;1-19-8-2-3-9-21(19)27-28(20-13-14-23(24(32)18-20)31(33)15-7-16-31)37-26-12-6-17-34-29(26)35-25-11-5-4-10-22(25)30(37)36-27;1-18(2,3)26-17(25)24-21(11-8-12-21)15-10-9-14(13-16(15)23)22-27-19(4,5)20(6,7)28-22;1-13-7-2-3-8-14(13)18-19(22)26-17-11-6-12-23-20(17)24-16-10-5-4-9-15(16)21(26)25-18;1-14-7-2-3-8-15(14)18-13-25-19-11-6-12-22-20(19)23-17-10-5-4-9-16(17)21(25)24-18;1-14-7-2-3-8-15(14)19(25)13-24-18-11-6-12-22-20(18)23-17-10-5-4-9-16(17)21(24)26;16-12-8-9-4-3-7-14-13(9)15-11-6-2-1-5-10(11)12;1-7-4-2-3-5-8(7)9(11)6-10;;;/h5-9,11-17,20-21H,10,18-19H2,1-4H3,(H,38,39)(H,41,43);2-6,8-14,17-18H,7,15-16,33H2,1H3,(H,34,35);9-10,13H,8,11-12H2,1-7H3,(H,24,25);2-12H,1H3,(H,23,24);2-13H,1H3,(H,22,23);2-12H,13H2,1H3,(H,22,23);1-7H,8H2,(H,14,15);2-5H,6H2,1H3;3*1H4.

What are the key properties of 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene?

2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene has a molecular weight of 3009.07 g/mol, XLogP of 41.53, 17 rotatable bonds, 9 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-1-(2-methylphenyl)ethanone;3-bromo-4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene;tert-butyl N-[1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutyl]carbamate;tert-butyl N-[1-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclobutyl]carbamate;5,11-dihydropyrido[2,3-b][1]benzazepin-6-one;1-[2-fluoro-4-[4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaen-3-yl]phenyl]cyclobutan-1-amine;methane;5-[2-(2-methylphenyl)-2-oxoethyl]-11H-pyrido[2,3-b][1,4]benzodiazepin-6-one;4-(2-methylphenyl)-2,5,13,15-tetrazatetracyclo[12.4.0.02,6.07,12]octadeca-1(14),3,5,7,9,11,15,17-octaene is sourced from PubChem (CID 160915157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).