3-[phenyl(trityloxy)methyl]-1H-indole

C34H27NO — CID 134974543

IUPAC3-[phenyl(trityloxy)methyl]-1H-indole
SMILESc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccccc2)c2c[nH]c3ccccc23)cc1
InChIInChI=1S/C34H27NO/c1-5-15-26(16-6-1)33(31-25-35-32-24-14-13-23-30(31)32)36-34(27-17-7-2-8-18-27,28-19-9-3-10-20-28)29-21-11-4-12-22-29/h1-25,33,35H
InChIKeyFZEXKBMATTWMSW-UHFFFAOYSA-N
MW465.60 g/mol
LogP8.27
Rot. Bonds7

About 3-[phenyl(trityloxy)methyl]-1H-indole

3-[phenyl(trityloxy)methyl]-1H-indole (PubChem CID 134974543) has the molecular formula C34H27NO and a molecular weight of 465.60 g/mol. Its IUPAC name is 3-[phenyl(trityloxy)methyl]-1H-indole.

Molecular Properties

Compound Name3-[phenyl(trityloxy)methyl]-1H-indole
PubChem CID134974543
Molecular FormulaC34H27NO
Molecular Weight465.60 g/mol
Exact Mass465.21
IUPAC Name3-[phenyl(trityloxy)methyl]-1H-indole
SMILESc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccccc2)c2c[nH]c3ccccc23)cc1
InChIInChI=1S/C34H27NO/c1-5-15-26(16-6-1)33(31-25-35-32-24-14-13-23-30(31)32)36-34(27-17-7-2-8-18-27,28-19-9-3-10-20-28)29-21-11-4-12-22-29/h1-25,33,35H
InChIKeyFZEXKBMATTWMSW-UHFFFAOYSA-N
XLogP8.27
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.60
LogP ≤ 58.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 3-[phenyl(trityloxy)methyl]-1H-indole 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-(1H-indol-3-yl)-2-phenylethanamine
CID 609935
1-(1H-indol-3-yl)-N-methyl-1-phenylmethanamine
CID 11322318
3-[methoxy-(2-methylphenyl)methyl]-1H-indole
CID 70574632
(1R,2R)-2-(1H-indol-3-yl)-1,2-diphenylethanol
CID 15981834
3-[2-(4-tert-butylphenyl)-1-(1H-indol-3-yl)ethyl]-1H-indole
CID 132529632
3-propan-2-yl-1H-indole
CID 12534824
3-[cyclopenta-2,4-dien-1-yl(phenyl)methyl]-1H-indole
CID 102035886
3-[phenyl(1H-pyrrol-2-yl)methyl]-1H-indole
CID 57468591
3-[(E)-1-phenylbut-2-enyl]-1H-indole
CID 10776889
3-[1H-indol-3-yl(phenyl)methyl]-5-methyl-1H-indole
CID 25098654
3-(2-nitro-1-phenylethyl)-1H-indole
CID 2740778
1-chloro-1-(1H-indol-3-yl)-N-methylmethanamine
CID 116962085

Frequently Asked Questions

What is the IUPAC name of 3-[phenyl(trityloxy)methyl]-1H-indole?
The IUPAC name of 3-[phenyl(trityloxy)methyl]-1H-indole (CID 134974543) is 3-[phenyl(trityloxy)methyl]-1H-indole.
What is the SMILES notation for 3-[phenyl(trityloxy)methyl]-1H-indole?
The canonical SMILES for 3-[phenyl(trityloxy)methyl]-1H-indole is c1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccccc2)c2c[nH]c3ccccc23)cc1.
What is the InChIKey of 3-[phenyl(trityloxy)methyl]-1H-indole?
The InChIKey is FZEXKBMATTWMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H27NO/c1-5-15-26(16-6-1)33(31-25-35-32-24-14-13-23-30(31)32)36-34(27-17-7-2-8-18-27,28-19-9-3-10-20-28)29-21-11-4-12-22-29/h1-25,33,35H.
What are the key properties of 3-[phenyl(trityloxy)methyl]-1H-indole?
3-[phenyl(trityloxy)methyl]-1H-indole has a molecular weight of 465.60 g/mol, XLogP of 8.27, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[phenyl(trityloxy)methyl]-1H-indole is sourced from PubChem (CID 134974543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).