6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one

C21H14N2O — CID 177421647

IUPAC6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one
SMILESO=c1c2ccccc2c2c3ccccc3[nH]c2n1-c1ccccc1
InChIInChI=1S/C21H14N2O/c24-21-16-11-5-4-10-15(16)19-17-12-6-7-13-18(17)22-20(19)23(21)14-8-2-1-3-9-14/h1-13,22H
InChIKeyZVGSTSTXSFBHFT-UHFFFAOYSA-N
MW310.36 g/mol
LogP4.63
Rot. Bonds1

About 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one

6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one (PubChem CID 177421647) has the molecular formula C21H14N2O and a molecular weight of 310.36 g/mol. Its IUPAC name is 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one.

Molecular Properties

Compound Name6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one
PubChem CID177421647
Molecular FormulaC21H14N2O
Molecular Weight310.36 g/mol
Exact Mass310.11
IUPAC Name6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one
SMILESO=c1c2ccccc2c2c3ccccc3[nH]c2n1-c1ccccc1
InChIInChI=1S/C21H14N2O/c24-21-16-11-5-4-10-15(16)19-17-12-6-7-13-18(17)22-20(19)23(21)14-8-2-1-3-9-14/h1-13,22H
InChIKeyZVGSTSTXSFBHFT-UHFFFAOYSA-N
XLogP4.63
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-6-phenyl-5H-indolo[2,3-b]indole
CID 146360267
3-[4-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]phenyl]-2-sulfanylidene-1H-quinazolin-4-one
CID 15134035
1-bromo-6-phenyl-5H-indolo[2,3-b]indole
CID 146360295
ethane;3-(4-methylphenyl)-1H-quinazoline-2,4-dione
CID 91492397
9-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 118509099
3-(4-aminophenyl)-1H-quinazoline-2,4-dione;ethane
CID 91428000
3,4-dimethyl-2-phenylisoquinolin-1-one;ethane
CID 165126064
3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 102175677
2-chloro-5-phenylpyrazino[2,3-c]isoquinolin-6-one
CID 146647879
6-bromo-3-phenyl-2-sulfanylidene-1H-quinazolin-4-one
CID 786570
24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.017,22]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene
CID 146341842
4-phenyl-[1,2,4]triazolo[4,3-a]quinazolin-10-ium-1,5-dione
CID 78210382

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one?
The IUPAC name of 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one (CID 177421647) is 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one.
What is the SMILES notation for 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one?
The canonical SMILES for 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one is O=c1c2ccccc2c2c3ccccc3[nH]c2n1-c1ccccc1.
What is the InChIKey of 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one?
The InChIKey is ZVGSTSTXSFBHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2O/c24-21-16-11-5-4-10-15(16)19-17-12-6-7-13-18(17)22-20(19)23(21)14-8-2-1-3-9-14/h1-13,22H.
What are the key properties of 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one?
6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one has a molecular weight of 310.36 g/mol, XLogP of 4.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-7H-indolo[2,3-c]isoquinolin-5-one is sourced from PubChem (CID 177421647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).