tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane

C174H199Cl2N31O21 — CID 159070048

About tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane

tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane (PubChem CID 159070048) has the molecular formula C174H199Cl2N31O21 and a molecular weight of 3131.61 g/mol. Its IUPAC name is tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane.

Molecular Properties

• Compound Name: tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane
• PubChem CID: 159070048
• Molecular Formula: C174H199Cl2N31O21
• Molecular Weight: 3131.61 g/mol
• Exact Mass: 3128.48
• IUPAC Name: tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane
• SMILES: C.C=CCCCNC(=O)c1ccc(Cc2nc(NCc3ccc(C=C)cc3)nc(OCC)n2)cc1.C=Cc1ccc(CN)cc1.C=Cc1ccc(CNc2nc(Cc3ccc(C(=O)O)cc3)nc(OCC)n2)cc1.C=Cc1ccc(CNc2nc(Cc3ccc(C(=O)OC(C)(C)C)cc3)nc(OCC)n2)cc1.CC(C)(C)OC(=O)c1ccc(N)cc1.CCOC(C)=O.CCOc1nc(Cl)nc(Cl)n1.CCOc1nc2nc(n1)NCc1ccc(cc1)C=CCCCNC(=O)c1ccc(cc1)C2.CCOc1nc2nc(n1)Nc1ccc(cc1)OCC=CCOc1ccc(cc1)C2.CCOc1nc2nc(n1)Nc1ccc(cc1)OCCCCOc1ccc(cc1)C2
• InChI: InChI=1S/C27H31N5O2.C26H30N4O3.C25H27N5O2.C22H24N4O3.2C22H22N4O3.C11H15NO2.C9H11N.C5H5Cl2N3O.C4H8O2.CH4/c1-4-7-8-17-28-25(33)23-15-13-21(14-16-23)18-24-30-26(32-27(31-24)34-6-3)29-19-22-11-9-20(5-2)10-12-22;1-6-18-8-10-20(11-9-18)17-27-24-28-22(29-25(30-24)32-7-2)16-19-12-14-21(15-13-19)23(31)33-26(3,4)5;1-2-32-25-29-22-16-19-11-13-21(14-12-19)23(31)26-15-5-3-4-6-18-7-9-20(10-8-18)17-27-24(28-22)30-25;2*1-2-27-22-25-20-15-16-5-9-18(10-6-16)28-13-3-4-14-29-19-11-7-17(8-12-19)23-21(24-20)26-22;1-3-15-5-7-17(8-6-15)14-23-21-24-19(25-22(26-21)29-4-2)13-16-9-11-18(12-10-16)20(27)28;1-11(2,3)14-10(13)8-4-6-9(12)7-5-8;1-2-8-3-5-9(7-10)6-4-8;1-2-11-5-9-3(6)8-4(7)10-5;1-3-6-4(2)5;/h4-5,9-16H,1-2,6-8,17-19H2,3H3,(H,28,33)(H,29,30,31,32);6,8-15H,1,7,16-17H2,2-5H3,(H,27,28,29,30);4,6-14H,2-3,5,15-17H2,1H3,(H,26,31)(H,27,28,29,30);5-12H,2-4,13-15H2,1H3,(H,23,24,25,26);3-12H,2,13-15H2,1H3,(H,23,24,25,26);3,5-12H,1,4,13-14H2,2H3,(H,27,28)(H,23,24,25,26);4-7H,12H2,1-3H3;2-6H,1,7,10H2;2H2,1H3;3H2,1-2H3;1H4
• InChIKey: JZNMSWIWKLUPDG-UHFFFAOYSA-N
• XLogP: 32.59
• TPSA: 670.84 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 49
• Rotatable Bonds: 43
• Heavy Atoms: 228
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3131.61
LogP ≤ 5	32.59
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	49

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane?

The IUPAC name of tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane (CID 159070048) is tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane.

What is the SMILES notation for tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane?

The canonical SMILES for tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane is C.C=CCCCNC(=O)c1ccc(Cc2nc(NCc3ccc(C=C)cc3)nc(OCC)n2)cc1.C=Cc1ccc(CN)cc1.C=Cc1ccc(CNc2nc(Cc3ccc(C(=O)O)cc3)nc(OCC)n2)cc1.C=Cc1ccc(CNc2nc(Cc3ccc(C(=O)OC(C)(C)C)cc3)nc(OCC)n2)cc1.CC(C)(C)OC(=O)c1ccc(N)cc1.CCOC(C)=O.CCOc1nc(Cl)nc(Cl)n1.CCOc1nc2nc(n1)NCc1ccc(cc1)C=CCCCNC(=O)c1ccc(cc1)C2.CCOc1nc2nc(n1)Nc1ccc(cc1)OCC=CCOc1ccc(cc1)C2.CCOc1nc2nc(n1)Nc1ccc(cc1)OCCCCOc1ccc(cc1)C2.

What is the InChIKey of tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane?

The InChIKey is JZNMSWIWKLUPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31N5O2.C26H30N4O3.C25H27N5O2.C22H24N4O3.2C22H22N4O3.C11H15NO2.C9H11N.C5H5Cl2N3O.C4H8O2.CH4/c1-4-7-8-17-28-25(33)23-15-13-21(14-16-23)18-24-30-26(32-27(31-24)34-6-3)29-19-22-11-9-20(5-2)10-12-22;1-6-18-8-10-20(11-9-18)17-27-24-28-22(29-25(30-24)32-7-2)16-19-12-14-21(15-13-19)23(31)33-26(3,4)5;1-2-32-25-29-22-16-19-11-13-21(14-12-19)23(31)26-15-5-3-4-6-18-7-9-20(10-8-18)17-27-24(28-22)30-25;2*1-2-27-22-25-20-15-16-5-9-18(10-6-16)28-13-3-4-14-29-19-11-7-17(8-12-19)23-21(24-20)26-22;1-3-15-5-7-17(8-6-15)14-23-21-24-19(25-22(26-21)29-4-2)13-16-9-11-18(12-10-16)20(27)28;1-11(2,3)14-10(13)8-4-6-9(12)7-5-8;1-2-8-3-5-9(7-10)6-4-8;1-2-11-5-9-3(6)8-4(7)10-5;1-3-6-4(2)5;/h4-5,9-16H,1-2,6-8,17-19H2,3H3,(H,28,33)(H,29,30,31,32);6,8-15H,1,7,16-17H2,2-5H3,(H,27,28,29,30);4,6-14H,2-3,5,15-17H2,1H3,(H,26,31)(H,27,28,29,30);5-12H,2-4,13-15H2,1H3,(H,23,24,25,26);3-12H,2,13-15H2,1H3,(H,23,24,25,26);3,5-12H,1,4,13-14H2,2H3,(H,27,28)(H,23,24,25,26);4-7H,12H2,1-3H3;2-6H,1,7,10H2;2H2,1H3;3H2,1-2H3;1H4.

What are the key properties of tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane?

tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane has a molecular weight of 3131.61 g/mol, XLogP of 32.59, 43 rotatable bonds, 11 hydrogen bond donors, and 49 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 4-aminobenzoate;tert-butyl 4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoate;2,4-dichloro-6-ethoxy-1,3,5-triazine;(4-ethenylphenyl)methanamine;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]benzoic acid;4-[[4-[(4-ethenylphenyl)methylamino]-6-ethoxy-1,3,5-triazin-2-yl]methyl]-N-pent-4-enylbenzamide;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),15,19,22-decaene;5-ethoxy-13,18-dioxa-2,4,6,26-tetrazatetracyclo[17.2.2.29,12.13,7]hexacosa-1(21),3,5,7(26),9(25),10,12(24),19,22-nonaene;5-ethoxy-4,6,8,19,28-pentazatetracyclo[19.2.2.210,13.13,7]octacosa-1(23),3(28),4,6,10(27),11,13(26),14,21,24-decaen-20-one;ethyl acetate;methane is sourced from PubChem (CID 159070048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).