2,4,6,8-tetraphenylquinazoline

C32H22N2 — CID 143301080

IUPAC2,4,6,8-tetraphenylquinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)c3nc(-c4ccccc4)nc(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C32H22N2/c1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)31-29(22-27)30(25-17-9-3-10-18-25)33-32(34-31)26-19-11-4-12-20-26/h1-22H
InChIKeyTXNUMEBVCPYDDM-UHFFFAOYSA-N
MW434.54 g/mol
LogP8.30
Rot. Bonds4

About 2,4,6,8-tetraphenylquinazoline

2,4,6,8-tetraphenylquinazoline (PubChem CID 143301080) has the molecular formula C32H22N2 and a molecular weight of 434.54 g/mol. Its IUPAC name is 2,4,6,8-tetraphenylquinazoline.

Molecular Properties

Compound Name2,4,6,8-tetraphenylquinazoline
PubChem CID143301080
Molecular FormulaC32H22N2
Molecular Weight434.54 g/mol
Exact Mass434.18
IUPAC Name2,4,6,8-tetraphenylquinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)c3nc(-c4ccccc4)nc(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C32H22N2/c1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)31-29(22-27)30(25-17-9-3-10-18-25)33-32(34-31)26-19-11-4-12-20-26/h1-22H
InChIKeyTXNUMEBVCPYDDM-UHFFFAOYSA-N
XLogP8.30
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.54
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4,6,8-tetraphenylquinazoline?
The IUPAC name of 2,4,6,8-tetraphenylquinazoline (CID 143301080) is 2,4,6,8-tetraphenylquinazoline.
What is the SMILES notation for 2,4,6,8-tetraphenylquinazoline?
The canonical SMILES for 2,4,6,8-tetraphenylquinazoline is c1ccc(-c2cc(-c3ccccc3)c3nc(-c4ccccc4)nc(-c4ccccc4)c3c2)cc1.
What is the InChIKey of 2,4,6,8-tetraphenylquinazoline?
The InChIKey is TXNUMEBVCPYDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22N2/c1-5-13-23(14-6-1)27-21-28(24-15-7-2-8-16-24)31-29(22-27)30(25-17-9-3-10-18-25)33-32(34-31)26-19-11-4-12-20-26/h1-22H.
What are the key properties of 2,4,6,8-tetraphenylquinazoline?
2,4,6,8-tetraphenylquinazoline has a molecular weight of 434.54 g/mol, XLogP of 8.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8-tetraphenylquinazoline is sourced from PubChem (CID 143301080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).