(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine

C313H608N34O22S2 — CID 159476939

About (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine

(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine (PubChem CID 159476939) has the molecular formula C313H608N34O22S2 and a molecular weight of 5264.66 g/mol. Its IUPAC name is (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine.

Molecular Properties

• Compound Name: (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine
• PubChem CID: 159476939
• Molecular Formula: C313H608N34O22S2
• Molecular Weight: 5264.66 g/mol
• Exact Mass: 5260.69
• IUPAC Name: (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C/C=N/C.C1=CN=CC1.C1=CN=CC1.C1CCOCC1.C=CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC#CC.CC#CC(C)C.CC#CCC.CC(=O)/C=C/c1ccc2c(c1)OCO2.CC(=O)N(C)C.CC(C)(C)O.CC=C(C)C.CC=C=C(C)C.CCC.CCC(C)=O.CN1CCCCC1.CNC(=O)NC.COC.COC(C)C.CON=C(C)C.COS(C)=O.Cc1ccc2[nH]ccc2c1.Cc1ccc2c(c1)CCO2.Cc1ccc2c(c1)OCCO2.Cc1ccc2c(c1)OCO2.Cc1ccc2c(ccn2C)c1.Cc1ccc2ncccc2c1.Cc1ccc2occc2c1.Cc1ccccc1.Cc1nc(C)nc(C)n1.Cc1nc2ccccc2o1.Cc1nnn(C)n1.Cc1nnnn1C.Cn1ccnc1.c1ccc2ocnc2c1.c1ccncc1.c1ccncc1.c1ccnnc1.c1ccoc1.c1ccsc1.c1cnccn1.c1cncnc1
• InChI: InChI=1S/C11H10O3.C10H11N.C10H9N.C9H9N.C9H10O2.C9H10O.C9H8O.C8H7NO.C8H8O2.C7H5NO.C7H8.C6H9N3.C6H13N.2C6H10.2C5H5N.C5H10O.C5H10.C5H8.C4H6N2.3C4H4N2.2C4H9NO.2C4H5N.C4H4O.2C4H10O.C4H8O.C4H4S.C4H6.2C3H6N4.C3H8N2O.C3H7N.C3H8.C3H6.C2H6O2S.C2H6O.32C2H6.25CH4/c1-8(12)2-3-9-4-5-10-11(6-9)14-7-13-10;1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-4-5-10-9(7-8)3-2-6-11-10;1-7-2-3-9-8(6-7)4-5-10-9;1-7-2-3-8-9(6-7)11-5-4-10-8;2*1-7-2-3-9-8(6-7)4-5-10-9;1-6-9-7-4-2-3-5-8(7)10-6;1-6-2-3-7-8(4-6)10-5-9-7;1-2-4-7-6(3-1)8-5-9-7;1-7-5-3-2-4-6-7;1-4-7-5(2)9-6(3)8-4;1-7-5-3-2-4-6-7;2*1-4-5-6(2)3;3*1-2-4-6-5-3-1;1-4-5(2)3;1-3-5-4-2;1-6-3-2-5-4-6;1-2-6-4-3-5-1;1-2-5-4-6-3-1;1-2-4-6-5-3-1;1-4(6)5(2)3;1-4(2)5-6-3;3*1-2-4-5-3-1;1-4(2)5-3;1-4(2,3)5;1-3-4(2)5;1-2-4-5-3-1;1-3-4-2;1-3-4-5-6-7(3)2;1-3-4-6-7(2)5-3;1-4-3(6)5-2;1-3-4-2;2*1-3-2;1-4-5(2)3;1-3-2;32*1-2;;;;;;;;;;;;;;;;;;;;;;;;;/h2-6H,7H2,1H3;3-7H,1-2H3;2-7H,1H3;2-6,10H,1H3;2-3,6H,4-5H2,1H3;2-3,6H,4-5H2,1H3;2-6H,1H3;2-5H,1H3;2-4H,5H2,1H3;1-5H;2-6H,1H3;1-3H3;2-6H2,1H3;6H,1-3H3;4H,1-3H3;2*1-5H;1-5H2;4H,1-3H3;3H2,1-2H3;2-4H,1H3;3*1-4H;2*1-3H3;2*1,3-4H,2H2;1-4H;4H,1-3H3;5H,1-3H3;3H2,1-2H3;1-4H;1-2H3;2*1-2H3;1-2H3,(H2,4,5,6);3H,1-2H3;3H2,1-2H3;3H,1H2,2H3;1-2H3;1-2H3;32*1-2H3;25*1H4/b3-2+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;4-3+
• InChIKey: LWMPELSJUPGJHG-YYKQHPAHSA-N
• XLogP: 98.69
• TPSA: 655.08 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 53
• Rotatable Bonds: 6
• Heavy Atoms: 371
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5264.66
LogP ≤ 5	98.69
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	53

Frequently Asked Questions

What is the IUPAC name of (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine?

The IUPAC name of (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine (CID 159476939) is (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine.

What is the SMILES notation for (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine?

The canonical SMILES for (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C/C=N/C.C1=CN=CC1.C1=CN=CC1.C1CCOCC1.C=CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC#CC.CC#CC(C)C.CC#CCC.CC(=O)/C=C/c1ccc2c(c1)OCO2.CC(=O)N(C)C.CC(C)(C)O.CC=C(C)C.CC=C=C(C)C.CCC.CCC(C)=O.CN1CCCCC1.CNC(=O)NC.COC.COC(C)C.CON=C(C)C.COS(C)=O.Cc1ccc2[nH]ccc2c1.Cc1ccc2c(c1)CCO2.Cc1ccc2c(c1)OCCO2.Cc1ccc2c(c1)OCO2.Cc1ccc2c(ccn2C)c1.Cc1ccc2ncccc2c1.Cc1ccc2occc2c1.Cc1ccccc1.Cc1nc(C)nc(C)n1.Cc1nc2ccccc2o1.Cc1nnn(C)n1.Cc1nnnn1C.Cn1ccnc1.c1ccc2ocnc2c1.c1ccncc1.c1ccncc1.c1ccnnc1.c1ccoc1.c1ccsc1.c1cnccn1.c1cncnc1.

What is the InChIKey of (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine?

The InChIKey is LWMPELSJUPGJHG-YYKQHPAHSA-N. The full InChI is InChI=1S/C11H10O3.C10H11N.C10H9N.C9H9N.C9H10O2.C9H10O.C9H8O.C8H7NO.C8H8O2.C7H5NO.C7H8.C6H9N3.C6H13N.2C6H10.2C5H5N.C5H10O.C5H10.C5H8.C4H6N2.3C4H4N2.2C4H9NO.2C4H5N.C4H4O.2C4H10O.C4H8O.C4H4S.C4H6.2C3H6N4.C3H8N2O.C3H7N.C3H8.C3H6.C2H6O2S.C2H6O.32C2H6.25CH4/c1-8(12)2-3-9-4-5-10-11(6-9)14-7-13-10;1-8-3-4-10-9(7-8)5-6-11(10)2;1-8-4-5-10-9(7-8)3-2-6-11-10;1-7-2-3-9-8(6-7)4-5-10-9;1-7-2-3-8-9(6-7)11-5-4-10-8;2*1-7-2-3-9-8(6-7)4-5-10-9;1-6-9-7-4-2-3-5-8(7)10-6;1-6-2-3-7-8(4-6)10-5-9-7;1-2-4-7-6(3-1)8-5-9-7;1-7-5-3-2-4-6-7;1-4-7-5(2)9-6(3)8-4;1-7-5-3-2-4-6-7;2*1-4-5-6(2)3;3*1-2-4-6-5-3-1;1-4-5(2)3;1-3-5-4-2;1-6-3-2-5-4-6;1-2-6-4-3-5-1;1-2-5-4-6-3-1;1-2-4-6-5-3-1;1-4(6)5(2)3;1-4(2)5-6-3;3*1-2-4-5-3-1;1-4(2)5-3;1-4(2,3)5;1-3-4(2)5;1-2-4-5-3-1;1-3-4-2;1-3-4-5-6-7(3)2;1-3-4-6-7(2)5-3;1-4-3(6)5-2;1-3-4-2;2*1-3-2;1-4-5(2)3;1-3-2;32*1-2;;;;;;;;;;;;;;;;;;;;;;;;;/h2-6H,7H2,1H3;3-7H,1-2H3;2-7H,1H3;2-6,10H,1H3;2-3,6H,4-5H2,1H3;2-3,6H,4-5H2,1H3;2-6H,1H3;2-5H,1H3;2-4H,5H2,1H3;1-5H;2-6H,1H3;1-3H3;2-6H2,1H3;6H,1-3H3;4H,1-3H3;2*1-5H;1-5H2;4H,1-3H3;3H2,1-2H3;2-4H,1H3;3*1-4H;2*1-3H3;2*1,3-4H,2H2;1-4H;4H,1-3H3;5H,1-3H3;3H2,1-2H3;1-4H;1-2H3;2*1-2H3;1-2H3,(H2,4,5,6);3H,1-2H3;3H2,1-2H3;3H,1H2,2H3;1-2H3;1-2H3;32*1-2H3;25*1H4/b3-2+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;4-3+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.

What are the key properties of (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine?

(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine has a molecular weight of 5264.66 g/mol, XLogP of 98.69, 6 rotatable bonds, 4 hydrogen bond donors, and 53 hydrogen bond acceptors.

Where does this data come from?

All data for (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one;1,3-benzoxazole;butan-2-one;but-2-yne;N,N-dimethylacetamide;1,5-dimethylindole;1,5-dimethyltetrazole;2,5-dimethyltetrazole;1,3-dimethylurea;ethane;furan;methane;methoxymethane;2-methoxypropane;N-methoxypropan-2-imine;5-methyl-1,3-benzodioxole;5-methyl-1-benzofuran;2-methyl-1,3-benzoxazole;2-methylbut-2-ene;6-methyl-2,3-dihydro-1,4-benzodioxine;5-methyl-2,3-dihydro-1-benzofuran;N-methylethanimine;1-methylimidazole;5-methyl-1H-indole;methyl methanesulfinate;2-methylpenta-2,3-diene;4-methylpent-2-yne;1-methylpiperidine;2-methylpropan-2-ol;6-methylquinoline;oxane;pent-2-yne;propane;prop-1-ene;pyrazine;pyridazine;bis(pyridine);pyrimidine;bis(3H-pyrrole);thiophene;toluene;2,4,6-trimethyl-1,3,5-triazine is sourced from PubChem (CID 159476939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).