[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one

C14H8N2OS — CID 848500

IUPAC[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one
SMILESO=c1cc2sc3ccccc3n2c2ncccc12
InChIInChI=1S/C14H8N2OS/c17-11-8-13-16(14-9(11)4-3-7-15-14)10-5-1-2-6-12(10)18-13/h1-8H
InChIKeyWLSKZUDSZUISSS-UHFFFAOYSA-N
MW252.30 g/mol
LogP3.06
Rot. Bonds

About [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one

[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one (PubChem CID 848500) has the molecular formula C14H8N2OS and a molecular weight of 252.30 g/mol. Its IUPAC name is [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one.

Molecular Properties

Compound Name[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one
PubChem CID848500
Molecular FormulaC14H8N2OS
Molecular Weight252.30 g/mol
Exact Mass252.04
IUPAC Name[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one
SMILESO=c1cc2sc3ccccc3n2c2ncccc12
InChIInChI=1S/C14H8N2OS/c17-11-8-13-16(14-9(11)4-3-7-15-14)10-5-1-2-6-12(10)18-13/h1-8H
InChIKeyWLSKZUDSZUISSS-UHFFFAOYSA-N
XLogP3.06
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-Amino-2-(Phenylamino)-1,3-Thiazol-5-Yl](Pyridin-3-Yl)methanone
CID 59974568
6-Methyl-2-(3-methyl-thiophen-2-yl)-1H-[1,8]naphthyridin-4-one
CID 395566
2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1-(3-pyridinyl)ethanone
CID 1581015
6-Methyl-2-(5-methyl-thiophen-2-yl)-1H-[1,8]naphthyridin-4-one
CID 10706234
1-ethyl-7-methyl-N-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-1,8-naphthyridine-3-carboxamide
CID 2102760
11-Thia-1,3,9-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),3,5,9,12,14,16-heptaen-8-one
CID 2754459
2,4,10-Triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),4,6,11,13,15-heptaen-17-one
CID 71588287
5-Oxo-12-hydrobenzothiazolo[3,2-e]pyridino[2,3-b]pyridine-6-carbonitrile
CID 2398452
1,4-Dihydro-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine
CID 91043094
7-Methylbenzimidazolo[1,2-a][1,8]naphthyridin-5-one
CID 395234
3-fluoro-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-5-oxo-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide
CID 16225517
3-fluoro-5-oxo-N-(2-pyrrolidin-1-ylethyl)-[1,3]benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide
CID 16225518

Frequently Asked Questions

What is the IUPAC name of [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one?
The IUPAC name of [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one (CID 848500) is [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one.
What is the SMILES notation for [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one?
The canonical SMILES for [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one is O=c1cc2sc3ccccc3n2c2ncccc12.
What is the InChIKey of [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one?
The InChIKey is WLSKZUDSZUISSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2OS/c17-11-8-13-16(14-9(11)4-3-7-15-14)10-5-1-2-6-12(10)18-13/h1-8H.
What are the key properties of [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one?
[1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one has a molecular weight of 252.30 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,3]benzothiazolo[3,2-a][1,8]naphthyridin-5-one is sourced from PubChem (CID 848500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).