4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide

C14H9FN2O2S2 — CID 2810154

IUPAC4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
SMILESCc1csc2c(=O)sc(NC(=O)c3ccc(F)cc3)nc12
InChIInChI=1S/C14H9FN2O2S2/c1-7-6-20-11-10(7)16-14(21-13(11)19)17-12(18)8-2-4-9(15)5-3-8/h2-6H,1H3,(H,16,17,18)
InChIKeyBTKQVTWFCFGYHS-UHFFFAOYSA-N
MW320.37 g/mol
LogP3.42
Rot. Bonds2

About 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide

4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide (PubChem CID 2810154) has the molecular formula C14H9FN2O2S2 and a molecular weight of 320.37 g/mol. Its IUPAC name is 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
PubChem CID2810154
Molecular FormulaC14H9FN2O2S2
Molecular Weight320.37 g/mol
Exact Mass320.01
IUPAC Name4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
SMILESCc1csc2c(=O)sc(NC(=O)c3ccc(F)cc3)nc12
InChIInChI=1S/C14H9FN2O2S2/c1-7-6-20-11-10(7)16-14(21-13(11)19)17-12(18)8-2-4-9(15)5-3-8/h2-6H,1H3,(H,16,17,18)
InChIKeyBTKQVTWFCFGYHS-UHFFFAOYSA-N
XLogP3.42
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-6-ethyl-5-(4-fluorophenyl)sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one
CID 44221146
N-(5-methyl-4-oxothieno[2,3-d][1,3]thiazin-2-yl)benzamide
CID 2809909
N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)thiophene-2-carboxamide
CID 2810073
4-chloro-N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
CID 2810142
2-chloro-4-fluoro-N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
CID 2810149
4-fluoro-N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide
CID 2810153
2-(Benzylsulfanyl)thieno[3,2-d]pyrimidin-4-ol
CID 135439659
2-[(1,4-Dihydro-5,6-Dimethyl-4-Oxothieno[2,3-d]Pyrimidin-2-ylThio]-N-(2-Fluorophenyl)-Acetamide
CID 1460286
N-(2,6-difluorophenyl)-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetamide
CID 7247215
2-[(3-Fluorophenyl)methylsulfanyl]-3-(2-methylpropyl)thieno[3,2-d]pyrimidin-4-one
CID 16024234
2-Amino-5-[(4-fluorophenyl)sulfanyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
CID 25107646
N-(4-oxothieno[3,2-d][1,3]thiazin-2-yl)-4-phenylbutanamide
CID 71681055

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide?
The IUPAC name of 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide (CID 2810154) is 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide.
What is the SMILES notation for 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide?
The canonical SMILES for 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide is Cc1csc2c(=O)sc(NC(=O)c3ccc(F)cc3)nc12.
What is the InChIKey of 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide?
The InChIKey is BTKQVTWFCFGYHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2S2/c1-7-6-20-11-10(7)16-14(21-13(11)19)17-12(18)8-2-4-9(15)5-3-8/h2-6H,1H3,(H,16,17,18).
What are the key properties of 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide?
4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide has a molecular weight of 320.37 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(7-methyl-4-oxothieno[3,2-d][1,3]thiazin-2-yl)benzamide is sourced from PubChem (CID 2810154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).