6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline

C22H13F3N2 — CID 162408579

IUPAC6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline
SMILESFC(F)(F)c1ccc2c(c1)nc(-c1ccccc1)n1c3ccccc3cc21
InChIInChI=1S/C22H13F3N2/c23-22(24,25)16-10-11-17-18(13-16)26-21(14-6-2-1-3-7-14)27-19-9-5-4-8-15(19)12-20(17)27/h1-13H
InChIKeyRGQCHYZAMGPCRP-UHFFFAOYSA-N
MW362.35 g/mol
LogP6.33
Rot. Bonds1

About 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline

6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline (PubChem CID 162408579) has the molecular formula C22H13F3N2 and a molecular weight of 362.35 g/mol. Its IUPAC name is 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline
PubChem CID162408579
Molecular FormulaC22H13F3N2
Molecular Weight362.35 g/mol
Exact Mass362.10
IUPAC Name6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline
SMILESFC(F)(F)c1ccc2c(c1)nc(-c1ccccc1)n1c3ccccc3cc21
InChIInChI=1S/C22H13F3N2/c23-22(24,25)16-10-11-17-18(13-16)26-21(14-6-2-1-3-7-14)27-19-9-5-4-8-15(19)12-20(17)27/h1-13H
InChIKeyRGQCHYZAMGPCRP-UHFFFAOYSA-N
XLogP6.33
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.35
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline?
The IUPAC name of 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline (CID 162408579) is 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline.
What is the SMILES notation for 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline?
The canonical SMILES for 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline is FC(F)(F)c1ccc2c(c1)nc(-c1ccccc1)n1c3ccccc3cc21.
What is the InChIKey of 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline?
The InChIKey is RGQCHYZAMGPCRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13F3N2/c23-22(24,25)16-10-11-17-18(13-16)26-21(14-6-2-1-3-7-14)27-19-9-5-4-8-15(19)12-20(17)27/h1-13H.
What are the key properties of 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline?
6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline has a molecular weight of 362.35 g/mol, XLogP of 6.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-3-(trifluoromethyl)indolo[1,2-c]quinazoline is sourced from PubChem (CID 162408579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).