bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline

C243H230N18OSSi2 — CID 164964284

IUPACbis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline
SMILESCC.CC.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccncc1.CN1c2ccccc2C(C)(C)c2ccccc21.CN1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21.CN1c2ccccc2N(c2ccccc2)c2ccccc21.CN1c2ccccc2Oc2ccccc21.CN1c2ccccc2Sc2ccccc21.CN1c2ccccc2[Si](C)(C)c2ccccc21.CN1c2ccccc2[Si](c2ccccc2)(c2ccccc2)c2ccccc21.Cc1ccccc1.Cc1ccccc1.Cn1c2ccccc2c2ccccc21.Cn1c2cccnc2c2ncccc21.c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H21N.C25H21NSi.C19H16N2.2C18H15N.C16H17N.C15H17NSi.C13H11NO.C13H11NS.C13H11N.2C13H13N.C12H12N2.C11H9N3.2C7H8.2C2H6/c1-27-24-18-10-8-16-22(24)26(20-12-4-2-5-13-20,21-14-6-3-7-15-21)23-17-9-11-19-25(23)27;1-26-22-16-8-10-18-24(22)27(20-12-4-2-5-13-20,21-14-6-3-7-15-21)25-19-11-9-17-23(25)26;1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-16(2)12-8-4-6-10-14(12)17(3)15-11-7-5-9-13(15)16;1-16-12-8-4-6-10-14(12)17(2,3)15-11-7-5-9-13(15)16;2*1-14-10-6-2-4-8-12(10)15-13-9-5-3-7-11(13)14;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-14(11-5-3-2-4-6-11)12-7-9-13-10-8-12;1-14-8-4-2-6-12-10(8)11-9(14)5-3-7-13-11;2*1-7-5-3-2-4-6-7;2*1-2/h2*2-19H,1H3;2-14H,1H3;2*1-15H;2*4-11H,1-3H3;2*2-9H,1H3;2-9H,1H3;2*2-11H,1H3;2-10H,1H3;2-7H,1H3;2*2-6H,1H3;2*1-2H3
InChIKeyCGOJFXGTGJYYGS-UHFFFAOYSA-N
MW3506.88 g/mol
LogP60.26
Rot. Bonds17

About bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline

bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline (PubChem CID 164964284) has the molecular formula C243H230N18OSSi2 and a molecular weight of 3506.88 g/mol. Its IUPAC name is bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline.

Molecular Properties

Compound Namebis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline
PubChem CID164964284
Molecular FormulaC243H230N18OSSi2
Molecular Weight3506.88 g/mol
Exact Mass3503.78
IUPAC Namebis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline
SMILESCC.CC.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccncc1.CN1c2ccccc2C(C)(C)c2ccccc21.CN1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21.CN1c2ccccc2N(c2ccccc2)c2ccccc21.CN1c2ccccc2Oc2ccccc21.CN1c2ccccc2Sc2ccccc21.CN1c2ccccc2[Si](C)(C)c2ccccc21.CN1c2ccccc2[Si](c2ccccc2)(c2ccccc2)c2ccccc21.Cc1ccccc1.Cc1ccccc1.Cn1c2ccccc2c2ccccc21.Cn1c2cccnc2c2ncccc21.c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H21N.C25H21NSi.C19H16N2.2C18H15N.C16H17N.C15H17NSi.C13H11NO.C13H11NS.C13H11N.2C13H13N.C12H12N2.C11H9N3.2C7H8.2C2H6/c1-27-24-18-10-8-16-22(24)26(20-12-4-2-5-13-20,21-14-6-3-7-15-21)23-17-9-11-19-25(23)27;1-26-22-16-8-10-18-24(22)27(20-12-4-2-5-13-20,21-14-6-3-7-15-21)25-19-11-9-17-23(25)26;1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-16(2)12-8-4-6-10-14(12)17(3)15-11-7-5-9-13(15)16;1-16-12-8-4-6-10-14(12)17(2,3)15-11-7-5-9-13(15)16;2*1-14-10-6-2-4-8-12(10)15-13-9-5-3-7-11(13)14;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-14(11-5-3-2-4-6-11)12-7-9-13-10-8-12;1-14-8-4-2-6-12-10(8)11-9(14)5-3-7-13-11;2*1-7-5-3-2-4-6-7;2*1-2/h2*2-19H,1H3;2-14H,1H3;2*1-15H;2*4-11H,1-3H3;2*2-9H,1H3;2-9H,1H3;2*2-11H,1H3;2-10H,1H3;2-7H,1H3;2*2-6H,1H3;2*1-2H3
InChIKeyCGOJFXGTGJYYGS-UHFFFAOYSA-N
XLogP60.26
TPSA99.88 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms265
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003506.88
LogP ≤ 560.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_thio_666_A(13)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline?
The IUPAC name of bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline (CID 164964284) is bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline.
What is the SMILES notation for bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline?
The canonical SMILES for bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline is CC.CC.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccccc1.CN(c1ccccc1)c1ccncc1.CN1c2ccccc2C(C)(C)c2ccccc21.CN1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21.CN1c2ccccc2N(c2ccccc2)c2ccccc21.CN1c2ccccc2Oc2ccccc21.CN1c2ccccc2Sc2ccccc21.CN1c2ccccc2[Si](C)(C)c2ccccc21.CN1c2ccccc2[Si](c2ccccc2)(c2ccccc2)c2ccccc21.Cc1ccccc1.Cc1ccccc1.Cn1c2ccccc2c2ccccc21.Cn1c2cccnc2c2ncccc21.c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc(N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline?
The InChIKey is CGOJFXGTGJYYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N.C25H21NSi.C19H16N2.2C18H15N.C16H17N.C15H17NSi.C13H11NO.C13H11NS.C13H11N.2C13H13N.C12H12N2.C11H9N3.2C7H8.2C2H6/c1-27-24-18-10-8-16-22(24)26(20-12-4-2-5-13-20,21-14-6-3-7-15-21)23-17-9-11-19-25(23)27;1-26-22-16-8-10-18-24(22)27(20-12-4-2-5-13-20,21-14-6-3-7-15-21)25-19-11-9-17-23(25)26;1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-16(2)12-8-4-6-10-14(12)17(3)15-11-7-5-9-13(15)16;1-16-12-8-4-6-10-14(12)17(2,3)15-11-7-5-9-13(15)16;2*1-14-10-6-2-4-8-12(10)15-13-9-5-3-7-11(13)14;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-14(11-5-3-2-4-6-11)12-7-9-13-10-8-12;1-14-8-4-2-6-12-10(8)11-9(14)5-3-7-13-11;2*1-7-5-3-2-4-6-7;2*1-2/h2*2-19H,1H3;2-14H,1H3;2*1-15H;2*4-11H,1-3H3;2*2-9H,1H3;2-9H,1H3;2*2-11H,1H3;2-10H,1H3;2-7H,1H3;2*2-6H,1H3;2*1-2H3.
What are the key properties of bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline?
bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline has a molecular weight of 3506.88 g/mol, XLogP of 60.26, 17 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N,N-diphenylaniline);ethane;9-methylcarbazole;10-methyl-9,9-diphenylacridine;5-methyl-10,10-diphenylbenzo[b][1,4]benzazasiline;10-methylphenothiazine;10-methylphenoxazine;bis(N-methyl-N-phenylaniline);5-methyl-10-phenylphenazine;N-methyl-N-phenylpyridin-4-amine;8-methyl-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;toluene;9,9,10-trimethylacridine;5,10,10-trimethylbenzo[b][1,4]benzazasiline is sourced from PubChem (CID 164964284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).