N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane

C228H370Cl2N28O31 — CID 159740238

About N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane

N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane (PubChem CID 159740238) has the molecular formula C228H370Cl2N28O31 and a molecular weight of 4070.54 g/mol. Its IUPAC name is N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane.

Molecular Properties

• Compound Name: N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane
• PubChem CID: 159740238
• Molecular Formula: C228H370Cl2N28O31
• Molecular Weight: 4070.54 g/mol
• Exact Mass: 4066.76
• IUPAC Name: N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane
• SMILES: C.C.C.C=CCC#N.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCO.COc1cc(CCC(=O)N(CCCCN)CCCN(CCCN(CCCCN)C(=O)CCc2ccc(OC)c(OC)c2)C(=O)OC(C)(C)C)ccc1C.COc1cc(CCC(=O)N(CCCCN)CCCNCCCN(CCCCN)C(=O)CCc2ccc(OC)c(OC)c2)ccc1C.Cc1ccc(CCC(=O)Cl)cc1C.Cc1ccc(CCC(=O)Cl)cc1C.Cc1ccc(CCC(=O)O)cc1C.NCCCCCCCN.[C-]#[N+]CCCCCCCCCCCCCCCC#N.[C-]#[N+]CCCCCCCCCCCCCCCC#N.[C-]#[N+]CCCN(CCCN(CCCN(CCCC#N)C(=O)CCc1ccc(OC)c(OC)c1)C(=O)OC(C)(C)C)C(=O)CCc1ccc(C)c(OC)c1.[C-]#[N+]CCN(CCC#N)C(=O)OC(C)(C)C.[C-]#[N+]CCNCCC#N
• InChI: InChI=1S/C41H59N5O7.C41H67N5O7.C36H59N5O5.2C17H30N2.2C11H13ClO.C11H17N3O2.C11H14O2.C10H18O5.C7H18N2.C6H9N3.C4H5N.C2H6O.3CH4/c1-32-14-15-33(30-36(32)51-7)17-20-39(48)45(25-11-23-43-5)27-13-29-46(40(49)53-41(2,3)4)28-12-26-44(24-10-9-22-42)38(47)21-18-34-16-19-35(50-6)37(31-34)52-8;1-32-14-15-33(30-36(32)51-6)17-20-38(47)44(24-10-8-22-42)26-12-28-46(40(49)53-41(2,3)4)29-13-27-45(25-11-9-23-43)39(48)21-18-34-16-19-35(50-5)37(31-34)52-7;1-29-11-12-30(27-33(29)45-3)14-17-35(42)40(23-7-5-19-37)25-9-21-39-22-10-26-41(24-8-6-20-38)36(43)18-15-31-13-16-32(44-2)34(28-31)46-4;2*1-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18;2*1-8-3-4-10(7-9(8)2)5-6-11(12)13;1-11(2,3)16-10(15)14(8-5-6-12)9-7-13-4;1-8-3-4-10(7-9(8)2)5-6-11(12)13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;8-6-4-2-1-3-5-7-9;1-8-5-6-9-4-2-3-7;1-2-3-4-5;1-2-3;;;/h14-16,19,30-31H,9-13,17-18,20-21,23-29H2,1-4,6-8H3;14-16,19,30-31H,8-13,17-18,20-29,42-43H2,1-7H3;11-13,16,27-28,39H,5-10,14-15,17-26,37-38H2,1-4H3;2*2-15,17H2;2*3-4,7H,5-6H2,1-2H3;5,7-9H2,1-3H3;3-4,7H,5-6H2,1-2H3,(H,12,13);1-6H3;1-9H2;9H,2,4-6H2;2H,1,3H2;3H,2H2,1H3;3*1H4
• InChIKey: NCJBNCLIKRXVPL-UHFFFAOYSA-N
• XLogP: 45.99
• TPSA: 791.77 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 44
• Rotatable Bonds: 125
• Heavy Atoms: 289
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4070.54
LogP ≤ 5	45.99
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	44

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane?

The IUPAC name of N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane (CID 159740238) is N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane.

What is the SMILES notation for N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane?

The canonical SMILES for N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane is C.C.C.C=CCC#N.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCO.COc1cc(CCC(=O)N(CCCCN)CCCN(CCCN(CCCCN)C(=O)CCc2ccc(OC)c(OC)c2)C(=O)OC(C)(C)C)ccc1C.COc1cc(CCC(=O)N(CCCCN)CCCNCCCN(CCCCN)C(=O)CCc2ccc(OC)c(OC)c2)ccc1C.Cc1ccc(CCC(=O)Cl)cc1C.Cc1ccc(CCC(=O)Cl)cc1C.Cc1ccc(CCC(=O)O)cc1C.NCCCCCCCN.[C-]#[N+]CCCCCCCCCCCCCCCC#N.[C-]#[N+]CCCCCCCCCCCCCCCC#N.[C-]#[N+]CCCN(CCCN(CCCN(CCCC#N)C(=O)CCc1ccc(OC)c(OC)c1)C(=O)OC(C)(C)C)C(=O)CCc1ccc(C)c(OC)c1.[C-]#[N+]CCN(CCC#N)C(=O)OC(C)(C)C.[C-]#[N+]CCNCCC#N.

What is the InChIKey of N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane?

The InChIKey is NCJBNCLIKRXVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H59N5O7.C41H67N5O7.C36H59N5O5.2C17H30N2.2C11H13ClO.C11H17N3O2.C11H14O2.C10H18O5.C7H18N2.C6H9N3.C4H5N.C2H6O.3CH4/c1-32-14-15-33(30-36(32)51-7)17-20-39(48)45(25-11-23-43-5)27-13-29-46(40(49)53-41(2,3)4)28-12-26-44(24-10-9-22-42)38(47)21-18-34-16-19-35(50-6)37(31-34)52-8;1-32-14-15-33(30-36(32)51-6)17-20-38(47)44(24-10-8-22-42)26-12-28-46(40(49)53-41(2,3)4)29-13-27-45(25-11-9-23-43)39(48)21-18-34-16-19-35(50-5)37(31-34)52-7;1-29-11-12-30(27-33(29)45-3)14-17-35(42)40(23-7-5-19-37)25-9-21-39-22-10-26-41(24-8-6-20-38)36(43)18-15-31-13-16-32(44-2)34(28-31)46-4;2*1-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18;2*1-8-3-4-10(7-9(8)2)5-6-11(12)13;1-11(2,3)16-10(15)14(8-5-6-12)9-7-13-4;1-8-3-4-10(7-9(8)2)5-6-11(12)13;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;8-6-4-2-1-3-5-7-9;1-8-5-6-9-4-2-3-7;1-2-3-4-5;1-2-3;;;/h14-16,19,30-31H,9-13,17-18,20-21,23-29H2,1-4,6-8H3;14-16,19,30-31H,8-13,17-18,20-29,42-43H2,1-7H3;11-13,16,27-28,39H,5-10,14-15,17-26,37-38H2,1-4H3;2*2-15,17H2;2*3-4,7H,5-6H2,1-2H3;5,7-9H2,1-3H3;3-4,7H,5-6H2,1-2H3,(H,12,13);1-6H3;1-9H2;9H,2,4-6H2;2H,1,3H2;3H,2H2,1H3;3*1H4.

What are the key properties of N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane?

N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane has a molecular weight of 4070.54 g/mol, XLogP of 45.99, 125 rotatable bonds, 10 hydrogen bond donors, and 44 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-aminobutyl)-N-[3-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propylamino]propyl]-3-(3-methoxy-4-methylphenyl)propanamide;but-3-enenitrile;tert-butyl N-[3-[4-aminobutyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[4-aminobutyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl N-(2-cyanoethyl)-N-(2-isocyanoethyl)carbamate;tert-butyl N-[3-[3-cyanopropyl-[3-(3,4-dimethoxyphenyl)propanoyl]amino]propyl]-N-[3-[3-isocyanopropyl-[3-(3-methoxy-4-methylphenyl)propanoyl]amino]propyl]carbamate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;3-(3,4-dimethylphenyl)propanoic acid;bis(3-(3,4-dimethylphenyl)propanoyl chloride);ethanol;heptane-1,7-diamine;3-(2-isocyanoethylamino)propanenitrile;bis(16-isocyanohexadecanenitrile);methane is sourced from PubChem (CID 159740238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).