N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide

C15H13ClFN3O3S — CID 59925925

IUPACN-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide
SMILESCC[C@H]1CN(c2ccc(C(=O)Nc3ncc(Cl)s3)c(F)c2)C(=O)O1
InChIInChI=1S/C15H13ClFN3O3S/c1-2-9-7-20(15(22)23-9)8-3-4-10(11(17)5-8)13(21)19-14-18-6-12(16)24-14/h3-6,9H,2,7H2,1H3,(H,18,19,21)/t9-/m0/s1
InChIKeyGBNKSPLAWTUWAZ-VIFPVBQESA-N
MW369.81 g/mol
LogP3.92
Rot. Bonds4

About N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide

N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide (PubChem CID 59925925) has the molecular formula C15H13ClFN3O3S and a molecular weight of 369.81 g/mol. Its IUPAC name is N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide
PubChem CID59925925
Molecular FormulaC15H13ClFN3O3S
Molecular Weight369.81 g/mol
Exact Mass369.04
IUPAC NameN-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide
SMILESCC[C@H]1CN(c2ccc(C(=O)Nc3ncc(Cl)s3)c(F)c2)C(=O)O1
InChIInChI=1S/C15H13ClFN3O3S/c1-2-9-7-20(15(22)23-9)8-3-4-10(11(17)5-8)13(21)19-14-18-6-12(16)24-14/h3-6,9H,2,7H2,1H3,(H,18,19,21)/t9-/m0/s1
InChIKeyGBNKSPLAWTUWAZ-VIFPVBQESA-N
XLogP3.92
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.81
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-N-(5-chloro-1,3-thiazol-2-yl)-2-fluorobenzamide
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4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-fluorobenzamide
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4-[(5S)-5-[(ethanethioylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methylsulfinyl-1,3-thiazol-2-yl)benzamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide?
The IUPAC name of N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide (CID 59925925) is N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide.
What is the SMILES notation for N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide?
The canonical SMILES for N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide is CC[C@H]1CN(c2ccc(C(=O)Nc3ncc(Cl)s3)c(F)c2)C(=O)O1.
What is the InChIKey of N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide?
The InChIKey is GBNKSPLAWTUWAZ-VIFPVBQESA-N. The full InChI is InChI=1S/C15H13ClFN3O3S/c1-2-9-7-20(15(22)23-9)8-3-4-10(11(17)5-8)13(21)19-14-18-6-12(16)24-14/h3-6,9H,2,7H2,1H3,(H,18,19,21)/t9-/m0/s1.
What are the key properties of N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide?
N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide has a molecular weight of 369.81 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide is sourced from PubChem (CID 59925925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).