[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane

C33H26N2Si — CID 158000610

IUPAC[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane
SMILESC[Si](c1ccccc1)(c1ccccc1)c1cccc(-c2ccc3nc4n(c3c2)-c2ccccc2C4)c1
InChIInChI=1S/C33H26N2Si/c1-36(27-13-4-2-5-14-27,28-15-6-3-7-16-28)29-17-10-12-24(21-29)25-19-20-30-32(22-25)35-31-18-9-8-11-26(31)23-33(35)34-30/h2-22H,23H2,1H3
InChIKeyNBWRSEUWOHQDSK-UHFFFAOYSA-N
MW478.67 g/mol
LogP5.70
Rot. Bonds4

About [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane

[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane (PubChem CID 158000610) has the molecular formula C33H26N2Si and a molecular weight of 478.67 g/mol. Its IUPAC name is [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane.

Molecular Properties

Compound Name[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane
PubChem CID158000610
Molecular FormulaC33H26N2Si
Molecular Weight478.67 g/mol
Exact Mass478.19
IUPAC Name[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane
SMILESC[Si](c1ccccc1)(c1ccccc1)c1cccc(-c2ccc3nc4n(c3c2)-c2ccccc2C4)c1
InChIInChI=1S/C33H26N2Si/c1-36(27-13-4-2-5-14-27,28-15-6-3-7-16-28)29-17-10-12-24(21-29)25-19-20-30-32(22-25)35-31-18-9-8-11-26(31)23-33(35)34-30/h2-22H,23H2,1H3
InChIKeyNBWRSEUWOHQDSK-UHFFFAOYSA-N
XLogP5.70
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.67
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane?
The IUPAC name of [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane (CID 158000610) is [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane.
What is the SMILES notation for [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane?
The canonical SMILES for [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane is C[Si](c1ccccc1)(c1ccccc1)c1cccc(-c2ccc3nc4n(c3c2)-c2ccccc2C4)c1.
What is the InChIKey of [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane?
The InChIKey is NBWRSEUWOHQDSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H26N2Si/c1-36(27-13-4-2-5-14-27,28-15-6-3-7-16-28)29-17-10-12-24(21-29)25-19-20-30-32(22-25)35-31-18-9-8-11-26(31)23-33(35)34-30/h2-22H,23H2,1H3.
What are the key properties of [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane?
[3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane has a molecular weight of 478.67 g/mol, XLogP of 5.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(11H-indolo[1,2-a]benzimidazol-7-yl)phenyl]-methyl-diphenylsilane is sourced from PubChem (CID 158000610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).