[8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

C171H134N24O22S4 — CID 159879403

About [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

[8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate (PubChem CID 159879403) has the molecular formula C171H134N24O22S4 and a molecular weight of 3005.37 g/mol. Its IUPAC name is [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate.

Molecular Properties

• Compound Name: [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
• PubChem CID: 159879403
• Molecular Formula: C171H134N24O22S4
• Molecular Weight: 3005.37 g/mol
• Exact Mass: 3002.90
• IUPAC Name: [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
• SMILES: C#Cc1cc2c(s1)C(c1ccccc1C)=NCc1c(COOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3sc(C#C)cc3-4)ncn1-2.C#Cc1cc2c(s1)C(c1ccccc1C)=NCc1c(COOCOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3sc(C#C)cc3-4)ncn1-2.C#Cc1ccc2c(c1)C(c1ccccc1C)=NCc1c(C(=O)OCOCOOCc3ncn4c3CN=C(c3ccccc3C)c3cc(C#CC)ccc3-4)ncn1-2.C#Cc1ccc2c(c1)C(c1ccccc1C)=NCc1c(COOCOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3cc(C#C)ccc3-4)ncn1-2
• InChI: InChI=1S/C45H36N6O6.C45H36N6O5.C41H32N6O6S2.C40H30N6O5S2/c1-5-31-15-17-38-35(19-31)42(33-13-9-7-11-29(33)3)46-21-40-37(48-24-50(38)40)23-56-57-28-54-26-53-27-55-45(52)44-41-22-47-43(34-14-10-8-12-30(34)4)36-20-32(6-2)16-18-39(36)51(41)25-49-44;1-5-11-32-17-19-38-36(21-32)43(34-15-10-8-13-30(34)4)46-22-40-37(48-25-50(38)40)24-55-56-28-53-27-54-45(52)44-41-23-47-42(33-14-9-7-12-29(33)3)35-20-31(6-2)16-18-39(35)51(41)26-49-44;1-5-27-15-32-39(54-27)36(29-13-9-7-11-25(29)3)42-17-34-31(44-20-46(32)34)19-52-53-24-50-22-49-23-51-41(48)38-35-18-43-37(30-14-10-8-12-26(30)4)40-33(47(35)21-45-38)16-28(6-2)55-40;1-5-26-15-31-38(52-26)35(28-13-9-7-11-24(28)3)41-17-33-30(43-20-45(31)33)19-50-51-23-48-22-49-40(47)37-34-18-42-36(29-14-10-8-12-25(29)4)39-32(46(34)21-44-37)16-27(6-2)53-39/h1-2,7-20,24-25H,21-23,26-28H2,3-4H3;2,7-10,12-21,25-26H,22-24,27-28H2,1,3-4H3;1-2,7-16,20-21H,17-19,22-24H2,3-4H3;1-2,7-16,20-21H,17-19,22-23H2,3-4H3
• InChIKey: NTIJAUHFGRJUSX-UHFFFAOYSA-N
• XLogP: 26.89
• TPSA: 475.86 Ų
• H-Bond Acceptors: 50
• Rotatable Bonds: 44
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3005.37
LogP ≤ 5	26.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate?

The IUPAC name of [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate (CID 159879403) is [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate.

What is the SMILES notation for [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate?

The canonical SMILES for [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate is C#Cc1cc2c(s1)C(c1ccccc1C)=NCc1c(COOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3sc(C#C)cc3-4)ncn1-2.C#Cc1cc2c(s1)C(c1ccccc1C)=NCc1c(COOCOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3sc(C#C)cc3-4)ncn1-2.C#Cc1ccc2c(c1)C(c1ccccc1C)=NCc1c(C(=O)OCOCOOCc3ncn4c3CN=C(c3ccccc3C)c3cc(C#CC)ccc3-4)ncn1-2.C#Cc1ccc2c(c1)C(c1ccccc1C)=NCc1c(COOCOCOCOC(=O)c3ncn4c3CN=C(c3ccccc3C)c3cc(C#C)ccc3-4)ncn1-2.

What is the InChIKey of [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate?

The InChIKey is NTIJAUHFGRJUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H36N6O6.C45H36N6O5.C41H32N6O6S2.C40H30N6O5S2/c1-5-31-15-17-38-35(19-31)42(33-13-9-7-11-29(33)3)46-21-40-37(48-24-50(38)40)23-56-57-28-54-26-53-27-55-45(52)44-41-22-47-43(34-14-10-8-12-30(34)4)36-20-32(6-2)16-18-39(36)51(41)25-49-44;1-5-11-32-17-19-38-36(21-32)43(34-15-10-8-13-30(34)4)46-22-40-37(48-25-50(38)40)24-55-56-28-53-27-54-45(52)44-41-23-47-42(33-14-9-7-12-29(33)3)35-20-31(6-2)16-18-39(35)51(41)26-49-44;1-5-27-15-32-39(54-27)36(29-13-9-7-11-25(29)3)42-17-34-31(44-20-46(32)34)19-52-53-24-50-22-49-23-51-41(48)38-35-18-43-37(30-14-10-8-12-26(30)4)40-33(47(35)21-45-38)16-28(6-2)55-40;1-5-26-15-31-38(52-26)35(28-13-9-7-11-24(28)3)41-17-33-30(43-20-45(31)33)19-50-51-23-48-22-49-40(47)37-34-18-42-36(29-14-10-8-12-25(29)4)39-32(46(34)21-44-37)16-27(6-2)53-39/h1-2,7-20,24-25H,21-23,26-28H2,3-4H3;2,7-10,12-21,25-26H,22-24,27-28H2,1,3-4H3;1-2,7-16,20-21H,17-19,22-24H2,3-4H3;1-2,7-16,20-21H,17-19,22-23H2,3-4H3.

What are the key properties of [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate?

[8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate has a molecular weight of 3005.37 g/mol, XLogP of 26.89, 44 rotatable bonds, 0 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for [8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaen-11-yl]methylperoxymethoxymethyl 4-ethynyl-7-(2-methylphenyl)-5-thia-1,8,12-triazatricyclo[8.3.0.02,6]trideca-2(6),3,7,10,12-pentaene-11-carboxylate;[6-(2-methylphenyl)-8-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]methylperoxymethoxymethyl 8-ethynyl-6-(2-methylphenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate is sourced from PubChem (CID 159879403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).