5-phenylindazolo[3,2-b]quinazolin-7-one

C20H13N3O — CID 57338719

IUPAC5-phenylindazolo[3,2-b]quinazolin-7-one
SMILESO=c1c2ccccc2nc2c3ccccc3n(-c3ccccc3)n12
InChIInChI=1S/C20H13N3O/c24-20-15-10-4-6-12-17(15)21-19-16-11-5-7-13-18(16)22(23(19)20)14-8-2-1-3-9-14/h1-13H
InChIKeyYKDMYEGAIGKOMR-UHFFFAOYSA-N
MW311.34 g/mol
LogP3.79
Rot. Bonds1

About 5-phenylindazolo[3,2-b]quinazolin-7-one

5-phenylindazolo[3,2-b]quinazolin-7-one (PubChem CID 57338719) has the molecular formula C20H13N3O and a molecular weight of 311.34 g/mol. Its IUPAC name is 5-phenylindazolo[3,2-b]quinazolin-7-one.

Molecular Properties

Compound Name5-phenylindazolo[3,2-b]quinazolin-7-one
PubChem CID57338719
Molecular FormulaC20H13N3O
Molecular Weight311.34 g/mol
Exact Mass311.11
IUPAC Name5-phenylindazolo[3,2-b]quinazolin-7-one
SMILESO=c1c2ccccc2nc2c3ccccc3n(-c3ccccc3)n12
InChIInChI=1S/C20H13N3O/c24-20-15-10-4-6-12-17(15)21-19-16-11-5-7-13-18(16)22(23(19)20)14-8-2-1-3-9-14/h1-13H
InChIKeyYKDMYEGAIGKOMR-UHFFFAOYSA-N
XLogP3.79
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

8-methyl-5-phenylindazolo[3,2-b]quinazolin-7-one
CID 102226681
9-methoxy-5-phenylindazolo[3,2-b]quinazolin-7-one
CID 86304179
10-chloro-5-phenylquinazolino[3,2-b]cinnoline-7,13-dione
CID 132500625
11-phenyl-5,7-dioxa-11,12,20-triazapentacyclo[10.8.0.02,10.04,8.014,19]icosa-1(20),2,4(8),9,14,16,18-heptaen-13-one
CID 71722413
5-tert-butylimino-6-phenylquinazolino[2,3-a]phthalazin-8-one
CID 102100633
3-phenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]quinazolin-4-one
CID 121247662
5-phosphanylbenzimidazolo[1,2-c]quinazolin-6-one
CID 71176384
3-(9-phenylcarbazol-3-yl)quinazolino[3,2-f]phenanthridin-14-one
CID 164913455
ethane;5H-quinoxalino[2,1-b]quinazoline-6,12-dione
CID 156863175
2-ethyl-3-phenylquinazolin-4-one
CID 719985
25-phenyl-2,9,17-triazahexacyclo[15.8.0.02,10.03,8.011,16.019,24]pentacosa-1(25),3,5,7,9,11,13,15,19,21,23-undecaen-18-one
CID 165126176
3-(dimethylamino)-2-ethylquinazolin-4-one
CID 10680290

Frequently Asked Questions

What is the IUPAC name of 5-phenylindazolo[3,2-b]quinazolin-7-one?
The IUPAC name of 5-phenylindazolo[3,2-b]quinazolin-7-one (CID 57338719) is 5-phenylindazolo[3,2-b]quinazolin-7-one.
What is the SMILES notation for 5-phenylindazolo[3,2-b]quinazolin-7-one?
The canonical SMILES for 5-phenylindazolo[3,2-b]quinazolin-7-one is O=c1c2ccccc2nc2c3ccccc3n(-c3ccccc3)n12.
What is the InChIKey of 5-phenylindazolo[3,2-b]quinazolin-7-one?
The InChIKey is YKDMYEGAIGKOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N3O/c24-20-15-10-4-6-12-17(15)21-19-16-11-5-7-13-18(16)22(23(19)20)14-8-2-1-3-9-14/h1-13H.
What are the key properties of 5-phenylindazolo[3,2-b]quinazolin-7-one?
5-phenylindazolo[3,2-b]quinazolin-7-one has a molecular weight of 311.34 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylindazolo[3,2-b]quinazolin-7-one is sourced from PubChem (CID 57338719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).