bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate

C182H222N12O37S6 — CID 157417697

About bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate

bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate (PubChem CID 157417697) has the molecular formula C182H222N12O37S6 and a molecular weight of 3362.23 g/mol. Its IUPAC name is bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate.

Molecular Properties

• Compound Name: bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate
• PubChem CID: 157417697
• Molecular Formula: C182H222N12O37S6
• Molecular Weight: 3362.23 g/mol
• Exact Mass: 3359.42
• IUPAC Name: bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate
• SMILES: CNCCn1c(=O)c2cc(OC)c(OC)cc2c2cnc3cc4c(cc3c21)OCO4.COc1cc2c(=O)n(CCN(C)C(=O)OCc3ccc(SSCCC(=O)CCCCCCCCCCCN4C5CCCC4CC(OC(=O)Cc4cc(C)ccc4CO)C5)cc3)c3c4cc5c(cc4ncc3c2cc1OC)OCO5.Cc1ccc(CO)c(CC(=O)OC2CC3CCCC(C2)N3CCCCCCCCCCCC(=O)CCSSc2ccc(CO)cc2)c1.Cc1ccc(CO)c(CC(=O)OC2CC3CCCC(C2)N3CCCCCCCCCCCC(=O)CCSSc2ccc(COC(=O)Oc3ccc([N+](=O)[O-])cc3)cc2)c1.O=C(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1
• InChI: InChI=1S/C62H76N4O11S2.C46H60N2O9S2.C39H57NO5S2.C22H21N3O5.C13H8N2O7/c1-41-18-21-43(38-67)44(29-41)30-59(69)77-48-31-45-15-14-16-46(32-48)65(45)25-13-11-9-7-5-6-8-10-12-17-47(68)24-28-78-79-49-22-19-42(20-23-49)39-74-62(71)64(2)26-27-66-60-52-35-57-58(76-40-75-57)36-54(52)63-37-53(60)50-33-55(72-3)56(73-4)34-51(50)61(66)70;1-34-15-18-36(32-49)37(28-34)29-45(51)56-43-30-39-12-11-13-40(31-43)47(39)26-10-8-6-4-2-3-5-7-9-14-41(50)25-27-58-59-44-23-16-35(17-24-44)33-55-46(52)57-42-21-19-38(20-22-42)48(53)54;1-30-15-18-32(29-42)33(24-30)25-39(44)45-37-26-34-12-11-13-35(27-37)40(34)22-10-8-6-4-2-3-5-7-9-14-36(43)21-23-46-47-38-19-16-31(28-41)17-20-38;1-23-4-5-25-21-14-8-19-20(30-11-29-19)9-16(14)24-10-15(21)12-6-17(27-2)18(28-3)7-13(12)22(25)26;16-13(21-11-5-1-9(2-6-11)14(17)18)22-12-7-3-10(4-8-12)15(19)20/h18-23,29,33-37,45-46,48,67H,5-17,24-28,30-32,38-40H2,1-4H3;15-24,28,39-40,43,49H,2-14,25-27,29-33H2,1H3;15-20,24,34-35,37,41-42H,2-14,21-23,25-29H2,1H3;6-10,23H,4-5,11H2,1-3H3;1-8H
• InChIKey: BPAVAUUJQTWKOU-UHFFFAOYSA-N
• XLogP: 37.67
• TPSA: 606.42 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 51
• Rotatable Bonds: 84
• Heavy Atoms: 237
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3362.23
LogP ≤ 5	37.67
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	51

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate?

The IUPAC name of bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate (CID 157417697) is bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate.

What is the SMILES notation for bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate?

The canonical SMILES for bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate is CNCCn1c(=O)c2cc(OC)c(OC)cc2c2cnc3cc4c(cc3c21)OCO4.COc1cc2c(=O)n(CCN(C)C(=O)OCc3ccc(SSCCC(=O)CCCCCCCCCCCN4C5CCCC4CC(OC(=O)Cc4cc(C)ccc4CO)C5)cc3)c3c4cc5c(cc4ncc3c2cc1OC)OCO5.Cc1ccc(CO)c(CC(=O)OC2CC3CCCC(C2)N3CCCCCCCCCCCC(=O)CCSSc2ccc(CO)cc2)c1.Cc1ccc(CO)c(CC(=O)OC2CC3CCCC(C2)N3CCCCCCCCCCCC(=O)CCSSc2ccc(COC(=O)Oc3ccc([N+](=O)[O-])cc3)cc2)c1.O=C(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1.

What is the InChIKey of bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate?

The InChIKey is BPAVAUUJQTWKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H76N4O11S2.C46H60N2O9S2.C39H57NO5S2.C22H21N3O5.C13H8N2O7/c1-41-18-21-43(38-67)44(29-41)30-59(69)77-48-31-45-15-14-16-46(32-48)65(45)25-13-11-9-7-5-6-8-10-12-17-47(68)24-28-78-79-49-22-19-42(20-23-49)39-74-62(71)64(2)26-27-66-60-52-35-57-58(76-40-75-57)36-54(52)63-37-53(60)50-33-55(72-3)56(73-4)34-51(50)61(66)70;1-34-15-18-36(32-49)37(28-34)29-45(51)56-43-30-39-12-11-13-40(31-43)47(39)26-10-8-6-4-2-3-5-7-9-14-41(50)25-27-58-59-44-23-16-35(17-24-44)33-55-46(52)57-42-21-19-38(20-22-42)48(53)54;1-30-15-18-32(29-42)33(24-30)25-39(44)45-37-26-34-12-11-13-35(27-37)40(34)22-10-8-6-4-2-3-5-7-9-14-36(43)21-23-46-47-38-19-16-31(28-41)17-20-38;1-23-4-5-25-21-14-8-19-20(30-11-29-19)9-16(14)24-10-15(21)12-6-17(27-2)18(28-3)7-13(12)22(25)26;16-13(21-11-5-1-9(2-6-11)14(17)18)22-12-7-3-10(4-8-12)15(19)20/h18-23,29,33-37,45-46,48,67H,5-17,24-28,30-32,38-40H2,1-4H3;15-24,28,39-40,43,49H,2-14,25-27,29-33H2,1H3;15-20,24,34-35,37,41-42H,2-14,21-23,25-29H2,1H3;6-10,23H,4-5,11H2,1-3H3;1-8H.

What are the key properties of bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate?

bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate has a molecular weight of 3362.23 g/mol, XLogP of 37.67, 84 rotatable bonds, 5 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-nitrophenyl) carbonate;16,17-dimethoxy-21-[2-(methylamino)ethyl]-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-20-one;[9-[14-[[4-[[2-(16,17-dimethoxy-20-oxo-5,7-dioxa-11,21-diazapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaen-21-yl)ethyl-methylcarbamoyl]oxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-(hydroxymethyl)phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate;[9-[14-[[4-[(4-nitrophenoxy)carbonyloxymethyl]phenyl]disulfanyl]-12-oxotetradecyl]-9-azabicyclo[3.3.1]nonan-3-yl] 2-[2-(hydroxymethyl)-5-methylphenyl]acetate is sourced from PubChem (CID 157417697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).