6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one

C19H16N2O2S — CID 9343705

IUPAC6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cc1
InChIInChI=1S/C19H16N2O2S/c1-23-15-6-2-12(3-7-15)19-21-17(11-24-19)14-4-8-16-13(10-14)5-9-18(22)20-16/h2-4,6-8,10-11H,5,9H2,1H3,(H,20,22)
InChIKeyGPZPSXPMTBPYDJ-UHFFFAOYSA-N
MW336.42 g/mol
LogP4.37
Rot. Bonds3

About 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one

6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 9343705) has the molecular formula C19H16N2O2S and a molecular weight of 336.42 g/mol. Its IUPAC name is 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID9343705
Molecular FormulaC19H16N2O2S
Molecular Weight336.42 g/mol
Exact Mass336.09
IUPAC Name6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1ccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cc1
InChIInChI=1S/C19H16N2O2S/c1-23-15-6-2-12(3-7-15)19-21-17(11-24-19)14-4-8-16-13(10-14)5-9-18(22)20-16/h2-4,6-8,10-11H,5,9H2,1H3,(H,20,22)
InChIKeyGPZPSXPMTBPYDJ-UHFFFAOYSA-N
XLogP4.37
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one (CID 9343705) is 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one is COc1ccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cc1.
What is the InChIKey of 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is GPZPSXPMTBPYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2S/c1-23-15-6-2-12(3-7-15)19-21-17(11-24-19)14-4-8-16-13(10-14)5-9-18(22)20-16/h2-4,6-8,10-11H,5,9H2,1H3,(H,20,22).
What are the key properties of 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 336.42 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 9343705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).