10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one

C21H13NO2 — CID 13000725

IUPAC10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one
SMILESO=c1cc2oc3ccc(-c4ccccc4)cc3n2c2ccccc12
InChIInChI=1S/C21H13NO2/c23-19-13-21-22(17-9-5-4-8-16(17)19)18-12-15(10-11-20(18)24-21)14-6-2-1-3-7-14/h1-13H
InChIKeyUQKHEPDVDCITQZ-UHFFFAOYSA-N
MW311.34 g/mol
LogP4.87
Rot. Bonds1

About 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one

10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one (PubChem CID 13000725) has the molecular formula C21H13NO2 and a molecular weight of 311.34 g/mol. Its IUPAC name is 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one.

Molecular Properties

Compound Name10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one
PubChem CID13000725
Molecular FormulaC21H13NO2
Molecular Weight311.34 g/mol
Exact Mass311.09
IUPAC Name10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one
SMILESO=c1cc2oc3ccc(-c4ccccc4)cc3n2c2ccccc12
InChIInChI=1S/C21H13NO2/c23-19-13-21-22(17-9-5-4-8-16(17)19)18-12-15(10-11-20(18)24-21)14-6-2-1-3-7-14/h1-13H
InChIKeyUQKHEPDVDCITQZ-UHFFFAOYSA-N
XLogP4.87
TPSA34.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-dibenzofuran-2-yl-[1,3]benzoxazolo[3,2-b]isoquinolin-11-one
CID 163394929
2-[8-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-yl)dibenzothiophen-2-yl]-7-(8-phenyldibenzothiophen-2-yl)xanthen-9-one
CID 176758603
2-[3-[3-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-yl)phenyl]phenyl]xanthen-9-one
CID 176758561
9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
CID 58536267
1-nitroso-2,7-diphenylimidazo[2,1-b][1,3]benzoxazole
CID 142724499
10,15-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8(20),9,11,13(18),14,16-nonaen-19-one
CID 146620445
1-tert-butyl-2-phenylquinolin-4-one
CID 166440287
4-[4-[3-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaen-4-yl)-5-phenylphenyl]phenyl]xanthen-9-one
CID 176758577
3-[4-(2-carbazol-9-yl-7-phenylcarbazol-9-yl)phenyl]xanthen-9-one
CID 142288913
11-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]indolo[2,1-b][1,3]benzoxazole
CID 164782309
9-methyl-3-(9-methylcarbazol-2-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 157228450
5,10-diphenyl-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 162740169

Frequently Asked Questions

What is the IUPAC name of 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one?
The IUPAC name of 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one (CID 13000725) is 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one.
What is the SMILES notation for 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one?
The canonical SMILES for 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one is O=c1cc2oc3ccc(-c4ccccc4)cc3n2c2ccccc12.
What is the InChIKey of 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one?
The InChIKey is UQKHEPDVDCITQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13NO2/c23-19-13-21-22(17-9-5-4-8-16(17)19)18-12-15(10-11-20(18)24-21)14-6-2-1-3-7-14/h1-13H.
What are the key properties of 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one?
10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one has a molecular weight of 311.34 g/mol, XLogP of 4.87, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-[1,3]benzoxazolo[3,2-a]quinolin-5-one is sourced from PubChem (CID 13000725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).