3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one

C16H10N2OS — CID 3569212

IUPAC3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one
SMILESO=c1c2ccccc2nc2scc(-c3ccccc3)n12
InChIInChI=1S/C16H10N2OS/c19-15-12-8-4-5-9-13(12)17-16-18(15)14(10-20-16)11-6-2-1-3-7-11/h1-10H
InChIKeyVHSKFCPJYPFSGP-UHFFFAOYSA-N
MW278.34 g/mol
LogP3.58
Rot. Bonds1

About 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one

3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one (PubChem CID 3569212) has the molecular formula C16H10N2OS and a molecular weight of 278.34 g/mol. Its IUPAC name is 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one.

Molecular Properties

Compound Name3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one
PubChem CID3569212
Molecular FormulaC16H10N2OS
Molecular Weight278.34 g/mol
Exact Mass278.05
IUPAC Name3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one
SMILESO=c1c2ccccc2nc2scc(-c3ccccc3)n12
InChIInChI=1S/C16H10N2OS/c19-15-12-8-4-5-9-13(12)17-16-18(15)14(10-20-16)11-6-2-1-3-7-11/h1-10H
InChIKeyVHSKFCPJYPFSGP-UHFFFAOYSA-N
XLogP3.58
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,5,6-triphenylimidazo[2,1-b][1,3]thiazole
CID 10760466
13-(4-ethoxyphenyl)-15-thia-8,12,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,8,13,16-heptaen-11-one
CID 23880567
6-(2-hydroxyethyl)-7-methyl-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 155809201
3,6-diphenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 82068552
9-(4-nitrophenyl)-12-phenyl-14-thia-8,11,16-triazatetracyclo[8.6.0.02,7.011,15]hexadeca-1(10),2,4,6,8,12,15-heptaene
CID 101436709
6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 82372908
5-diethoxyphosphoryl-3,6-diphenylimidazo[2,1-b][1,3]thiazole
CID 132516192
7-[(dibenzylamino)methyl]-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 50802741
N-cyclohexyl-5-oxo-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 4224151
methyl 5-chloro-3-phenylimidazo[2,1-b][1,3]thiazole-6-carboxylate
CID 165492506
3-phenyl-6-(piperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 3469841
6-phenylisoquinolino[2,1-b]isoquinolin-8-one
CID 164679594

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The IUPAC name of 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one (CID 3569212) is 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one.
What is the SMILES notation for 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The canonical SMILES for 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one is O=c1c2ccccc2nc2scc(-c3ccccc3)n12.
What is the InChIKey of 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The InChIKey is VHSKFCPJYPFSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2OS/c19-15-12-8-4-5-9-13(12)17-16-18(15)14(10-20-16)11-6-2-1-3-7-11/h1-10H.
What are the key properties of 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one?
3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one has a molecular weight of 278.34 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one is sourced from PubChem (CID 3569212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).