6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione

C12H10FN3O2S — CID 20713893

IUPAC6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
SMILESCNc1cc2c(cc1F)c(=O)c1c(=O)[nH]sc1n2C
InChIInChI=1S/C12H10FN3O2S/c1-14-7-4-8-5(3-6(7)13)10(17)9-11(18)15-19-12(9)16(8)2/h3-4,14H,1-2H3,(H,15,18)
InChIKeyFJDSJACDXQCSMB-UHFFFAOYSA-N
MW279.30 g/mol
LogP1.62
Rot. Bonds1

About 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione

6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione (PubChem CID 20713893) has the molecular formula C12H10FN3O2S and a molecular weight of 279.30 g/mol. Its IUPAC name is 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione.

Molecular Properties

Compound Name6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
PubChem CID20713893
Molecular FormulaC12H10FN3O2S
Molecular Weight279.30 g/mol
Exact Mass279.05
IUPAC Name6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
SMILESCNc1cc2c(cc1F)c(=O)c1c(=O)[nH]sc1n2C
InChIInChI=1S/C12H10FN3O2S/c1-14-7-4-8-5(3-6(7)13)10(17)9-11(18)15-19-12(9)16(8)2/h3-4,14H,1-2H3,(H,15,18)
InChIKeyFJDSJACDXQCSMB-UHFFFAOYSA-N
XLogP1.62
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione 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

9-cyclopropyl-6,7-difluoro-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 14668979
7-(ethylamino)-6-fluoro-9-(2-methyl-4-pyridinyl)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 54526762
6-fluoro-9-propyl-7-thiophen-3-yl-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 89431341
9-cyclopropyl-6-fluoro-7-(2-methoxy-4-methylphenyl)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 58426801
9-cyclopropyl-7-(diazepin-1-yl)-6-fluoro-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 19981974
9-cyclopropyl-6-fluoro-7-(4-methoxyiminopiperidin-1-yl)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 11589452
7-(3-aminocyclopentyl)-9-(2,4-difluorophenyl)-6-fluoro-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 57015750
7-[3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-9-cyclopropyl-6-fluoro-[1,2]thiazolo[5,4-b]quinoline-3,4-dione;hydrochloride
CID 66742002
9-cyclopropyl-6-fluoro-7-[2-(4-methoxyphenyl)ethynyl]-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 58426832
9-cyclopropyl-6-fluoro-7-[4-(piperidin-1-ylmethyl)phenyl]-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 58426798
N-[1-(9-cyclopropyl-6-fluoro-3,4-dioxo-[1,2]thiazolo[5,4-b]quinolin-7-yl)azetidin-3-yl]-2,2,2-trifluoro-N-methylacetamide
CID 10027065
9-cyclopropyl-6-fluoro-7-(2-phenylacetyl)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione
CID 58426901

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione?
The IUPAC name of 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione (CID 20713893) is 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione.
What is the SMILES notation for 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione?
The canonical SMILES for 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione is CNc1cc2c(cc1F)c(=O)c1c(=O)[nH]sc1n2C.
What is the InChIKey of 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione?
The InChIKey is FJDSJACDXQCSMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O2S/c1-14-7-4-8-5(3-6(7)13)10(17)9-11(18)15-19-12(9)16(8)2/h3-4,14H,1-2H3,(H,15,18).
What are the key properties of 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione?
6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione has a molecular weight of 279.30 g/mol, XLogP of 1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-9-methyl-7-(methylamino)-[1,2]thiazolo[5,4-b]quinoline-3,4-dione is sourced from PubChem (CID 20713893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).