2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium

C60H65N3O5Os — CID 159216528

IUPAC2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium
SMILESCCCCCCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)cc1.Cc1ccc2c(c1)C(C)(c1ccc(COCCOCCOCCO)c([CH+][C-]=O)c1)c1cc(C)ccc1-2.[Os]
InChIInChI=1S/C31H34O5.C29H31N3.Os/c1-22-4-8-27-28-9-5-23(2)19-30(28)31(3,29(27)18-22)26-7-6-25(24(20-26)10-11-32)21-36-17-16-35-15-14-34-13-12-33;1-4-5-6-7-8-23-13-19-26(20-14-23)29-31-27(24-15-9-21(2)10-16-24)30-28(32-29)25-17-11-22(3)12-18-25;/h4-10,18-20,33H,12-17,21H2,1-3H3;9-20H,4-8H2,1-3H3;
InChIKeyUDDCUANYSXLTPY-UHFFFAOYSA-N
MW1098.43 g/mol
LogP12.45
Rot. Bonds21

About 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium

2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium (PubChem CID 159216528) has the molecular formula C60H65N3O5Os and a molecular weight of 1098.43 g/mol. Its IUPAC name is 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium.

Molecular Properties

Compound Name2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium
PubChem CID159216528
Molecular FormulaC60H65N3O5Os
Molecular Weight1098.43 g/mol
Exact Mass1099.45
IUPAC Name2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium
SMILESCCCCCCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)cc1.Cc1ccc2c(c1)C(C)(c1ccc(COCCOCCOCCO)c([CH+][C-]=O)c1)c1cc(C)ccc1-2.[Os]
InChIInChI=1S/C31H34O5.C29H31N3.Os/c1-22-4-8-27-28-9-5-23(2)19-30(28)31(3,29(27)18-22)26-7-6-25(24(20-26)10-11-32)21-36-17-16-35-15-14-34-13-12-33;1-4-5-6-7-8-23-13-19-26(20-14-23)29-31-27(24-15-9-21(2)10-16-24)30-28(32-29)25-17-11-22(3)12-18-25;/h4-10,18-20,33H,12-17,21H2,1-3H3;9-20H,4-8H2,1-3H3;
InChIKeyUDDCUANYSXLTPY-UHFFFAOYSA-N
XLogP12.45
TPSA103.66 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds21
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001098.43
LogP ≤ 512.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-bis(4-tert-butylphenyl)-6-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-1,3,5-triazine
CID 58412099
2-[6-[9-(4-hexylphenyl)-7,9-dimethylfluoren-2-yl]-3-pyridinyl]-4,6-bis[4-(2,4,4-trimethylpentan-2-yl)phenyl]-1,3,5-triazine
CID 140941428
2-[4-[2-[4-(2,5-dihexyl-4-methylphenyl)phenoxy]ethoxy]phenyl]-4-[4-[2-(4-methylphenoxy)ethoxy]phenyl]-6-(4-methylphenyl)-1,3,5-triazine;bis(N-[4-[4-[4-(2,5-dihexyl-4-methylphenyl)phenyl]butyl]phenyl]-4-methyl-N-[4-[4-(4-methylphenyl)butyl]phenyl]aniline);2-[4-[2-[2-[[4-(2,5-dihexyl-4-methylphenyl)phenyl]methoxy]ethoxy]ethoxymethyl]phenyl]-4-(4-methylphenyl)-6-[4-[2-[2-[(4-methylphenyl)methoxy]ethoxy]ethoxymethyl]phenyl]-1,3,5-triazine
CID 159555018
2,4-bis(2,4-dimethylphenyl)-6-[4-(4-hexylphenyl)phenyl]-1,3,5-triazine
CID 118244537
1,4-dihexyl-2,5-dimethylbenzene;2,7-dimethyl-9,9-bis(4-octylphenyl)fluorene
CID 159632047
2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-4-nonylphenol
CID 23293321
2-[4-[2-ethyl-4-(4-hexylphenyl)phenyl]phenoxy]ethanol
CID 163793056
2-[4-[4-[4-(3,4-dimethylphenyl)-2,5-dihexylphenyl]-2-methylphenyl]phenyl]-4-(4-hexylphenyl)-6-(4-methylphenyl)-1,3,5-triazine
CID 90192426
2,4-bis(tert-butylsulfanyl)-6-[4-[9-(4-hexylphenyl)-2-methyl-7-(7-methyl-9,9-dioctylfluoren-2-yl)fluoren-9-yl]phenyl]-1,3,5-triazine
CID 58078201
ethyl 5-[2-[9-(3,5-dihexylphenyl)-7-[9-[3-ethoxycarbonyl-4-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]phenyl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-3-methyl-7-phenylfluoren-2-yl]-9-methylfluoren-2-yl]-9-[3-ethoxycarbonyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-3-methyl-7-phenylfluoren-9-yl]-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]benzoate
CID 164738649
2-(4-butylphenyl)-4-methyl-6-(4-methylphenyl)-1,3,5-triazine;ethane
CID 145044910
2-(2-hydroxyethoxy)ethanol;4-octylphenol
CID 158887559

Frequently Asked Questions

What is the IUPAC name of 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium?
The IUPAC name of 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium (CID 159216528) is 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium.
What is the SMILES notation for 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium?
The canonical SMILES for 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium is CCCCCCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)cc1.Cc1ccc2c(c1)C(C)(c1ccc(COCCOCCOCCO)c([CH+][C-]=O)c1)c1cc(C)ccc1-2.[Os].
What is the InChIKey of 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium?
The InChIKey is UDDCUANYSXLTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H34O5.C29H31N3.Os/c1-22-4-8-27-28-9-5-23(2)19-30(28)31(3,29(27)18-22)26-7-6-25(24(20-26)10-11-32)21-36-17-16-35-15-14-34-13-12-33;1-4-5-6-7-8-23-13-19-26(20-14-23)29-31-27(24-15-9-21(2)10-16-24)30-28(32-29)25-17-11-22(3)12-18-25;/h4-10,18-20,33H,12-17,21H2,1-3H3;9-20H,4-8H2,1-3H3;.
What are the key properties of 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium?
2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium has a molecular weight of 1098.43 g/mol, XLogP of 12.45, 21 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hexylphenyl)-4,6-bis(4-methylphenyl)-1,3,5-triazine;2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxymethyl]-5-(2,7,9-trimethylfluoren-9-yl)phenyl]ethanone;osmium is sourced from PubChem (CID 159216528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).