tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride

C167H179ClN22O34 — CID 159753987

About tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride

tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride (PubChem CID 159753987) has the molecular formula C167H179ClN22O34 and a molecular weight of 3073.84 g/mol. Its IUPAC name is tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride.

Molecular Properties

• Compound Name: tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride
• PubChem CID: 159753987
• Molecular Formula: C167H179ClN22O34
• Molecular Weight: 3073.84 g/mol
• Exact Mass: 3071.26
• IUPAC Name: tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride
• SMILES: C.CC(C)c1cc(-c2n[nH]c(=O)n2-c2ccc3c(ccn3CCCC3CCNCC3)c2)c(O)cc1O.CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)N1CCC(CCCn2ccc3cc(-n4c(-c5cc(C(C)C)c(O)cc5O)n[nH]c4=O)ccc32)CC1.CCc1c2c(nc3ccc(OC(=O)OC(C)(C)C)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)N1CCC(CCCn2ccc3cc(-n4c(-c5cc(C(C)C)c(O)cc5O)n[nH]c4=O)ccc32)CC1.CCc1c2c(nc3ccc(OC(=O)OC(C)(C)C)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)Oc1ccc([N+](=O)[O-])cc1.Cl
• InChI: InChI=1S/C55H59N7O11.C50H51N7O9.C34H31N3O11.C27H33N5O3.CH4.ClH/c1-8-35-37-24-34(71-53(69)73-54(5,6)7)13-14-42(37)56-47-39(35)28-61-44(47)26-41-40(49(61)65)29-70-50(66)55(41,9-2)72-52(68)60-20-16-31(17-21-60)11-10-19-59-22-18-32-23-33(12-15-43(32)59)62-48(57-58-51(62)67)38-25-36(30(3)4)45(63)27-46(38)64;1-5-32-34-21-31(58)10-11-39(34)51-44-36(32)25-56-41(44)23-38-37(46(56)61)26-65-47(62)50(38,6-2)66-49(64)55-17-13-28(14-18-55)8-7-16-54-19-15-29-20-30(9-12-40(29)54)57-45(52-53-48(57)63)35-22-33(27(3)4)42(59)24-43(35)60;1-6-21-22-14-20(46-31(40)47-33(3,4)5)12-13-26(22)35-28-23(21)16-36-27(28)15-25-24(29(36)38)17-44-30(39)34(25,7-2)48-32(41)45-19-10-8-18(9-11-19)37(42)43;1-17(2)21-15-22(25(34)16-24(21)33)26-29-30-27(35)32(26)20-5-6-23-19(14-20)9-13-31(23)12-3-4-18-7-10-28-11-8-18;;/h12-15,18,22-27,30-31,63-64H,8-11,16-17,19-21,28-29H2,1-7H3,(H,58,67);9-12,15,19-24,27-28,58-60H,5-8,13-14,16-18,25-26H2,1-4H3,(H,53,63);8-15H,6-7,16-17H2,1-5H3;5-6,9,13-18,28,33-34H,3-4,7-8,10-12H2,1-2H3,(H,30,35);1H4;1H
• InChIKey: HOSFDCKCKRIADP-UHFFFAOYSA-N
• XLogP: 28.68
• TPSA: 712.85 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 50
• Rotatable Bonds: 34
• Heavy Atoms: 224
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3073.84
LogP ≤ 5	28.68
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phenyl_carbonate', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride?

The IUPAC name of tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride (CID 159753987) is tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride.

What is the SMILES notation for tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride?

The canonical SMILES for tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride is C.CC(C)c1cc(-c2n[nH]c(=O)n2-c2ccc3c(ccn3CCCC3CCNCC3)c2)c(O)cc1O.CCc1c2c(nc3ccc(O)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)N1CCC(CCCn2ccc3cc(-n4c(-c5cc(C(C)C)c(O)cc5O)n[nH]c4=O)ccc32)CC1.CCc1c2c(nc3ccc(OC(=O)OC(C)(C)C)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)N1CCC(CCCn2ccc3cc(-n4c(-c5cc(C(C)C)c(O)cc5O)n[nH]c4=O)ccc32)CC1.CCc1c2c(nc3ccc(OC(=O)OC(C)(C)C)cc13)-c1cc3c(c(=O)n1C2)COC(=O)C3(CC)OC(=O)Oc1ccc([N+](=O)[O-])cc1.Cl.

What is the InChIKey of tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride?

The InChIKey is HOSFDCKCKRIADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H59N7O11.C50H51N7O9.C34H31N3O11.C27H33N5O3.CH4.ClH/c1-8-35-37-24-34(71-53(69)73-54(5,6)7)13-14-42(37)56-47-39(35)28-61-44(47)26-41-40(49(61)65)29-70-50(66)55(41,9-2)72-52(68)60-20-16-31(17-21-60)11-10-19-59-22-18-32-23-33(12-15-43(32)59)62-48(57-58-51(62)67)38-25-36(30(3)4)45(63)27-46(38)64;1-5-32-34-21-31(58)10-11-39(34)51-44-36(32)25-56-41(44)23-38-37(46(56)61)26-65-47(62)50(38,6-2)66-49(64)55-17-13-28(14-18-55)8-7-16-54-19-15-29-20-30(9-12-40(29)54)57-45(52-53-48(57)63)35-22-33(27(3)4)42(59)24-43(35)60;1-6-21-22-14-20(46-31(40)47-33(3,4)5)12-13-26(22)35-28-23(21)16-36-27(28)15-25-24(29(36)38)17-44-30(39)34(25,7-2)48-32(41)45-19-10-8-18(9-11-19)37(42)43;1-17(2)21-15-22(25(34)16-24(21)33)26-29-30-27(35)32(26)20-5-6-23-19(14-20)9-13-31(23)12-3-4-18-7-10-28-11-8-18;;/h12-15,18,22-27,30-31,63-64H,8-11,16-17,19-21,28-29H2,1-7H3,(H,58,67);9-12,15,19-24,27-28,58-60H,5-8,13-14,16-18,25-26H2,1-4H3,(H,53,63);8-15H,6-7,16-17H2,1-5H3;5-6,9,13-18,28,33-34H,3-4,7-8,10-12H2,1-2H3,(H,30,35);1H4;1H.

What are the key properties of tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride?

tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride has a molecular weight of 3073.84 g/mol, XLogP of 28.68, 34 rotatable bonds, 11 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl [10,19-diethyl-19-(4-nitrophenoxy)carbonyloxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] carbonate;(10,19-diethyl-7-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl) 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;[10,19-diethyl-7-[(2-methylpropan-2-yl)oxycarbonyloxy]-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-19-yl] 4-[3-[5-[3-(2,4-dihydroxy-5-propan-2-ylphenyl)-5-oxo-1H-1,2,4-triazol-4-yl]indol-1-yl]propyl]piperidine-1-carboxylate;3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-[1-(3-piperidin-4-ylpropyl)indol-5-yl]-1H-1,2,4-triazol-5-one;methane;hydrochloride is sourced from PubChem (CID 159753987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).