7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one

C16H15FN2O3S — CID 154770255

IUPAC7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one
SMILESCOCc1nc(Cn2ccc(=O)c3cc(OC)c(F)cc32)cs1
InChIInChI=1S/C16H15FN2O3S/c1-21-8-16-18-10(9-23-16)7-19-4-3-14(20)11-5-15(22-2)12(17)6-13(11)19/h3-6,9H,7-8H2,1-2H3
InChIKeyIZYZMVWNHAUPQG-UHFFFAOYSA-N
MW334.37 g/mol
LogP2.80
Rot. Bonds5

About 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one

7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one (PubChem CID 154770255) has the molecular formula C16H15FN2O3S and a molecular weight of 334.37 g/mol. Its IUPAC name is 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one.

Molecular Properties

Compound Name7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one
PubChem CID154770255
Molecular FormulaC16H15FN2O3S
Molecular Weight334.37 g/mol
Exact Mass334.08
IUPAC Name7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one
SMILESCOCc1nc(Cn2ccc(=O)c3cc(OC)c(F)cc32)cs1
InChIInChI=1S/C16H15FN2O3S/c1-21-8-16-18-10(9-23-16)7-19-4-3-14(20)11-5-15(22-2)12(17)6-13(11)19/h3-6,9H,7-8H2,1-2H3
InChIKeyIZYZMVWNHAUPQG-UHFFFAOYSA-N
XLogP2.80
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one with MolForge

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Related Compounds

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CID 82793448
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CID 165482461
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4-[(4-cyclopropyl-7-fluoro-2,3-dihydroquinoxalin-1-yl)methyl]-2-(methoxymethyl)-1,3-thiazole
CID 86800186
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CID 116623853
4-[(3,4-dimethoxy-2-pyridinyl)methyl]thieno[3,2-b]pyridin-7-one
CID 99832866
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CID 110398411
4-[[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]methyl]-2-[(4-fluorophenoxy)methyl]-1,3-thiazole
CID 112798687
3-chloro-1-[[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-(trifluoromethyl)pyridin-2-one
CID 34964059
4-[(5,6-difluorobenzimidazol-1-yl)methyl]-2-propyl-1,3-thiazole
CID 115582415
4,6-dichloro-1-[(3-fluoro-4-methoxyphenyl)methyl]indole
CID 103428306
ethane;6-fluoro-5-methoxy-1-methylindole
CID 144622311

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one?
The IUPAC name of 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one (CID 154770255) is 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one.
What is the SMILES notation for 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one?
The canonical SMILES for 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one is COCc1nc(Cn2ccc(=O)c3cc(OC)c(F)cc32)cs1.
What is the InChIKey of 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one?
The InChIKey is IZYZMVWNHAUPQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O3S/c1-21-8-16-18-10(9-23-16)7-19-4-3-14(20)11-5-15(22-2)12(17)6-13(11)19/h3-6,9H,7-8H2,1-2H3.
What are the key properties of 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one?
7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one has a molecular weight of 334.37 g/mol, XLogP of 2.80, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-methoxy-1-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]quinolin-4-one is sourced from PubChem (CID 154770255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).