3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione

C181H204N36O31 — CID 165041469

About 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione

3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione (PubChem CID 165041469) has the molecular formula C181H204N36O31 and a molecular weight of 3379.84 g/mol. Its IUPAC name is 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione.

Molecular Properties

• Compound Name: 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione
• PubChem CID: 165041469
• Molecular Formula: C181H204N36O31
• Molecular Weight: 3379.84 g/mol
• Exact Mass: 3377.55
• IUPAC Name: 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione
• SMILES: CC(C)COC(=O)N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)CC1.CC(C)COC(=O)c1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ccccc3C4=O)CC2)nc1.CC1(C)CCC(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)NC1.CC1(C)CN=C(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)OC1.COc1cc(C)ccc1N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)CC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCC1CCC2(CCCC2)CN1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCC(Cc2ccccc2)CC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCC2(CCCO2)CC1
• InChI: InChI=1S/C27H30N6O5.C25H27N5O4.C25H26N4O3.C22H27N5O5.C22H26N4O3.C21H24N4O4.C20H24N4O3.C19H20N4O4/c1-18(2)17-38-27(36)19-8-9-22(28-16-19)31-14-12-30(13-15-31)10-5-11-32-24-23(29-33(32)37)25(34)20-6-3-4-7-21(20)26(24)35;1-17-8-9-20(21(16-17)34-2)28-14-12-27(13-15-28)10-5-11-29-23-22(26-30(29)33)24(31)18-6-3-4-7-19(18)25(23)32;30-24-20-9-4-5-10-21(20)25(31)23-22(24)26-29(32)28(23)14-6-13-27-15-11-19(12-16-27)17-18-7-2-1-3-8-18;1-15(2)14-32-22(30)25-12-10-24(11-13-25)8-5-9-26-19-18(23-27(26)31)20(28)16-6-3-4-7-17(16)21(19)29;27-20-16-7-1-2-8-17(16)21(28)19-18(20)24-26(29)25(19)13-5-6-15-9-12-22(14-23-15)10-3-4-11-22;26-19-15-5-1-2-6-16(15)20(27)18-17(19)22-25(28)24(18)11-4-10-23-12-8-21(9-13-23)7-3-14-29-21;1-20(2)10-9-13(21-12-20)6-5-11-23-17-16(22-24(23)27)18(25)14-7-3-4-8-15(14)19(17)26;1-19(2)10-20-14(27-11-19)8-5-9-22-16-15(21-23(22)26)17(24)12-6-3-4-7-13(12)18(16)25/h3-4,6-9,16,18H,5,10-15,17H2,1-2H3;3-4,6-9,16H,5,10-15H2,1-2H3;1-5,7-10,19H,6,11-17H2;3-4,6-7,15H,5,8-14H2,1-2H3;1-2,7-8,15,23H,3-6,9-14H2;1-2,5-6H,3-4,7-14H2;3-4,7-8,13,21H,5-6,9-12H2,1-2H3;3-4,6-7H,5,8-11H2,1-2H3
• InChIKey: OERZSYYYGHYYGE-UHFFFAOYSA-N
• XLogP: 14.35
• TPSA: 786.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 58
• Rotatable Bonds: 42
• Heavy Atoms: 248
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3379.84
LogP ≤ 5	14.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	58

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione?

The IUPAC name of 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione (CID 165041469) is 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione.

What is the SMILES notation for 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione?

The canonical SMILES for 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione is CC(C)COC(=O)N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)CC1.CC(C)COC(=O)c1ccc(N2CCN(CCCn3c4c(n[n+]3[O-])C(=O)c3ccccc3C4=O)CC2)nc1.CC1(C)CCC(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)NC1.CC1(C)CN=C(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)OC1.COc1cc(C)ccc1N1CCN(CCCn2c3c(n[n+]2[O-])C(=O)c2ccccc2C3=O)CC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCC1CCC2(CCCC2)CN1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCC(Cc2ccccc2)CC1.O=C1c2ccccc2C(=O)c2c1n[n+]([O-])n2CCCN1CCC2(CCCO2)CC1.

What is the InChIKey of 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione?

The InChIKey is OERZSYYYGHYYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N6O5.C25H27N5O4.C25H26N4O3.C22H27N5O5.C22H26N4O3.C21H24N4O4.C20H24N4O3.C19H20N4O4/c1-18(2)17-38-27(36)19-8-9-22(28-16-19)31-14-12-30(13-15-31)10-5-11-32-24-23(29-33(32)37)25(34)20-6-3-4-7-21(20)26(24)35;1-17-8-9-20(21(16-17)34-2)28-14-12-27(13-15-28)10-5-11-29-23-22(26-30(29)33)24(31)18-6-3-4-7-19(18)25(23)32;30-24-20-9-4-5-10-21(20)25(31)23-22(24)26-29(32)28(23)14-6-13-27-15-11-19(12-16-27)17-18-7-2-1-3-8-18;1-15(2)14-32-22(30)25-12-10-24(11-13-25)8-5-9-26-19-18(23-27(26)31)20(28)16-6-3-4-7-17(16)21(19)29;27-20-16-7-1-2-8-17(16)21(28)19-18(20)24-26(29)25(19)13-5-6-15-9-12-22(14-23-15)10-3-4-11-22;26-19-15-5-1-2-6-16(15)20(27)18-17(19)22-25(28)24(18)11-4-10-23-12-8-21(9-13-23)7-3-14-29-21;1-20(2)10-9-13(21-12-20)6-5-11-23-17-16(22-24(23)27)18(25)14-7-3-4-8-15(14)19(17)26;1-19(2)10-20-14(27-11-19)8-5-9-22-16-15(21-23(22)26)17(24)12-6-3-4-7-13(12)18(16)25/h3-4,6-9,16,18H,5,10-15,17H2,1-2H3;3-4,6-9,16H,5,10-15H2,1-2H3;1-5,7-10,19H,6,11-17H2;3-4,6-7,15H,5,8-14H2,1-2H3;1-2,7-8,15,23H,3-6,9-14H2;1-2,5-6H,3-4,7-14H2;3-4,7-8,13,21H,5-6,9-12H2,1-2H3;3-4,6-7H,5,8-11H2,1-2H3.

What are the key properties of 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione?

3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione has a molecular weight of 3379.84 g/mol, XLogP of 14.35, 42 rotatable bonds, 2 hydrogen bond donors, and 58 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-(7-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(4-benzylpiperidin-1-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethyl-4,6-dihydro-1,3-oxazin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-(5,5-dimethylpiperidin-2-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;3-[3-[4-(2-methoxy-4-methylphenyl)piperazin-1-yl]propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione;2-methylpropyl 4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazine-1-carboxylate;2-methylpropyl 6-[4-[3-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)propyl]piperazin-1-yl]pyridine-3-carboxylate;3-[3-(1-oxa-8-azaspiro[4.5]decan-8-yl)propyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione is sourced from PubChem (CID 165041469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).