5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol

C157H154ClN18O15S+3 — CID 158550195

About 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol

5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol (PubChem CID 158550195) has the molecular formula C157H154ClN18O15S+3 and a molecular weight of 2600.59 g/mol. Its IUPAC name is 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol.

Molecular Properties

• Compound Name: 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol
• PubChem CID: 158550195
• Molecular Formula: C157H154ClN18O15S+3
• Molecular Weight: 2600.59 g/mol
• Exact Mass: 2598.12
• IUPAC Name: 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol
• SMILES: CCCCCCCCOC(=O)CCc1cc(-n2n3c4ccc(Cl)cc4n23)c(O)c(C(C)(C)C)c1.CCCCOc1ccc(-c2nc(-c3ccc(OCCCC)cc3O)nc(-c3ccc(OCCCC)cc3OCCCC)n2)c(O)c1.Cc1ccccc1-[n+]1c2ccccc2nn1-c1ccccc1O.Cc1ccccc1-[n+]1c2cccnc2nn1-c1ccccc1O.Oc1ccccc1-c1nc2cc(-c3ccccc3)ccc2o1.Oc1ccccc1-c1nc2cc(-c3ccccc3)ccc2s1.Oc1ccccc1-n1nc2ccccc2[n+]1-c1ccccc1
• InChI: InChI=1S/C37H47N3O6.C27H36ClN3O3.C19H15N3O.C19H13NO2.C19H13NOS.C18H14N4O.C18H13N3O/c1-5-9-19-43-26-13-16-29(32(41)23-26)35-38-36(30-17-14-27(24-33(30)42)44-20-10-6-2)40-37(39-35)31-18-15-28(45-21-11-7-3)25-34(31)46-22-12-8-4;1-5-6-7-8-9-10-15-34-25(32)14-11-19-16-21(27(2,3)4)26(33)24(17-19)31-29-22-13-12-20(28)18-23(22)30(29)31;1-14-8-2-4-10-16(14)21-17-11-5-3-9-15(17)20-22(21)18-12-6-7-13-19(18)23;2*21-17-9-5-4-8-15(17)19-20-16-12-14(10-11-18(16)22-19)13-6-2-1-3-7-13;1-13-7-2-3-8-14(13)21-16-10-6-12-19-18(16)20-22(21)15-9-4-5-11-17(15)23;22-18-13-7-6-12-17(18)21-19-15-10-4-5-11-16(15)20(21)14-8-2-1-3-9-14/h13-18,23-25,41-42H,5-12,19-22H2,1-4H3;12-13,16-18,33H,5-11,14-15H2,1-4H3;2-13H,1H3;2*1-12,21H;2-12H,1H3;1-13H/p+3
• InChIKey: WGNJQZXKOLYTIG-UHFFFAOYSA-Q
• XLogP: 35.15
• TPSA: 394.39 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 31
• Rotatable Bonds: 40
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2600.59
LogP ≤ 5	35.15
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol?

The IUPAC name of 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol (CID 158550195) is 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol.

What is the SMILES notation for 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol?

The canonical SMILES for 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol is CCCCCCCCOC(=O)CCc1cc(-n2n3c4ccc(Cl)cc4n23)c(O)c(C(C)(C)C)c1.CCCCOc1ccc(-c2nc(-c3ccc(OCCCC)cc3O)nc(-c3ccc(OCCCC)cc3OCCCC)n2)c(O)c1.Cc1ccccc1-[n+]1c2ccccc2nn1-c1ccccc1O.Cc1ccccc1-[n+]1c2cccnc2nn1-c1ccccc1O.Oc1ccccc1-c1nc2cc(-c3ccccc3)ccc2o1.Oc1ccccc1-c1nc2cc(-c3ccccc3)ccc2s1.Oc1ccccc1-n1nc2ccccc2[n+]1-c1ccccc1.

What is the InChIKey of 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol?

The InChIKey is WGNJQZXKOLYTIG-UHFFFAOYSA-Q. The full InChI is InChI=1S/C37H47N3O6.C27H36ClN3O3.C19H15N3O.C19H13NO2.C19H13NOS.C18H14N4O.C18H13N3O/c1-5-9-19-43-26-13-16-29(32(41)23-26)35-38-36(30-17-14-27(24-33(30)42)44-20-10-6-2)40-37(39-35)31-18-15-28(45-21-11-7-3)25-34(31)46-22-12-8-4;1-5-6-7-8-9-10-15-34-25(32)14-11-19-16-21(27(2,3)4)26(33)24(17-19)31-29-22-13-12-20(28)18-23(22)30(29)31;1-14-8-2-4-10-16(14)21-17-11-5-3-9-15(17)20-22(21)18-12-6-7-13-19(18)23;2*21-17-9-5-4-8-15(17)19-20-16-12-14(10-11-18(16)22-19)13-6-2-1-3-7-13;1-13-7-2-3-8-14(13)21-16-10-6-12-19-18(16)20-22(21)15-9-4-5-11-17(15)23;22-18-13-7-6-12-17(18)21-19-15-10-4-5-11-16(15)20(21)14-8-2-1-3-9-14/h13-18,23-25,41-42H,5-12,19-22H2,1-4H3;12-13,16-18,33H,5-11,14-15H2,1-4H3;2-13H,1H3;2*1-12,21H;2-12H,1H3;1-13H/p+3.

What are the key properties of 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol?

5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol has a molecular weight of 2600.59 g/mol, XLogP of 35.15, 40 rotatable bonds, 8 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-butoxy-2-[4-(4-butoxy-2-hydroxyphenyl)-6-(2,4-dibutoxyphenyl)-1,3,5-triazin-2-yl]phenol;2-[1-(2-methylphenyl)benzotriazol-1-ium-2-yl]phenol;2-[1-(2-methylphenyl)triazolo[4,5-b]pyridin-1-ium-2-yl]phenol;octyl 3-[3-tert-butyl-5-(3-chloro-7,8,9-triazatricyclo[4.3.0.07,9]nona-1(6),2,4-trien-8-yl)-4-hydroxyphenyl]propanoate;2-(5-phenyl-1,3-benzothiazol-2-yl)phenol;2-(1-phenylbenzotriazol-1-ium-2-yl)phenol;2-(5-phenyl-1,3-benzoxazol-2-yl)phenol is sourced from PubChem (CID 158550195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).