6-(4-methoxyphenyl)indolo[1,2-c]quinazoline

C22H16N2O — CID 102452205

IUPAC6-(4-methoxyphenyl)indolo[1,2-c]quinazoline
SMILESCOc1ccc(-c2nc3ccccc3c3cc4ccccc4n23)cc1
InChIInChI=1S/C22H16N2O/c1-25-17-12-10-15(11-13-17)22-23-19-8-4-3-7-18(19)21-14-16-6-2-5-9-20(16)24(21)22/h2-14H,1H3
InChIKeyJCKRGKXHJRCEHE-UHFFFAOYSA-N
MW324.38 g/mol
LogP5.32
Rot. Bonds2

About 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline

6-(4-methoxyphenyl)indolo[1,2-c]quinazoline (PubChem CID 102452205) has the molecular formula C22H16N2O and a molecular weight of 324.38 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-(4-methoxyphenyl)indolo[1,2-c]quinazoline
PubChem CID102452205
Molecular FormulaC22H16N2O
Molecular Weight324.38 g/mol
Exact Mass324.13
IUPAC Name6-(4-methoxyphenyl)indolo[1,2-c]quinazoline
SMILESCOc1ccc(-c2nc3ccccc3c3cc4ccccc4n23)cc1
InChIInChI=1S/C22H16N2O/c1-25-17-12-10-15(11-13-17)22-23-19-8-4-3-7-18(19)21-14-16-6-2-5-9-20(16)24(21)22/h2-14H,1H3
InChIKeyJCKRGKXHJRCEHE-UHFFFAOYSA-N
XLogP5.32
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline?
The IUPAC name of 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline (CID 102452205) is 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline.
What is the SMILES notation for 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline?
The canonical SMILES for 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline is COc1ccc(-c2nc3ccccc3c3cc4ccccc4n23)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline?
The InChIKey is JCKRGKXHJRCEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O/c1-25-17-12-10-15(11-13-17)22-23-19-8-4-3-7-18(19)21-14-16-6-2-5-9-20(16)24(21)22/h2-14H,1H3.
What are the key properties of 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline?
6-(4-methoxyphenyl)indolo[1,2-c]quinazoline has a molecular weight of 324.38 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)indolo[1,2-c]quinazoline is sourced from PubChem (CID 102452205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).