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

C20H18N2O3S — CID 9204894

IUPAC6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1cccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)c1OC
InChIInChI=1S/C20H18N2O3S/c1-24-17-5-3-4-14(19(17)25-2)20-22-16(11-26-20)13-6-8-15-12(10-13)7-9-18(23)21-15/h3-6,8,10-11H,7,9H2,1-2H3,(H,21,23)
InChIKeyLSBFXZCSSICYIO-UHFFFAOYSA-N
MW366.44 g/mol
LogP4.38
Rot. Bonds4

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

6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 9204894) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID9204894
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC Name6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
SMILESCOc1cccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)c1OC
InChIInChI=1S/C20H18N2O3S/c1-24-17-5-3-4-14(19(17)25-2)20-22-16(11-26-20)13-6-8-15-12(10-13)7-9-18(23)21-15/h3-6,8,10-11H,7,9H2,1-2H3,(H,21,23)
InChIKeyLSBFXZCSSICYIO-UHFFFAOYSA-N
XLogP4.38
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

2-(3-methoxyphenyl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 2796264
2-(3-Methoxy-4-methylthiophenyl)-4-(3,4-dihydrocarbostyril-6-yl)thiazole
CID 10022798
6-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10067479
6-[2-(4-methoxy-3-propoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10250038
6-[2-(3,4-dimethoxybenzoyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10430727
6-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10453244
2-(3-Methoxy-4-methylsulfinylphenyl)-4-(3,4-dihydrocarbostyril-6-yl)thiazole
CID 11741592
6-[2-(3,4-dihydroxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one;hydrobromide
CID 135770630
6-[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 9343481
6-[2-(3-ethoxy-4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10249207
6-[2-(3-butoxy-4-methoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one
CID 10409189
6-(2,3-Dihydrobenzo[b][1,4]dioxin-5-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)piperidin-2-one
CID 69080983

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one (CID 9204894) is 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one is COc1cccc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)c1OC.
What is the InChIKey of 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is LSBFXZCSSICYIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S/c1-24-17-5-3-4-14(19(17)25-2)20-22-16(11-26-20)13-6-8-15-12(10-13)7-9-18(23)21-15/h3-6,8,10-11H,7,9H2,1-2H3,(H,21,23).
What are the key properties of 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one?
6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 366.44 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 9204894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).