4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide

C20H17N3O5S — CID 167909594

IUPAC4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide
SMILESO=C1OCCN1c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cn2)cc1
InChIInChI=1S/C20H17N3O5S/c24-20-23(12-13-27-20)15-6-9-18(10-7-15)29(25,26)22-19-11-8-17(14-21-19)28-16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,21,22)
InChIKeyGLKSUYYDBOPYAV-UHFFFAOYSA-N
MW411.44 g/mol
LogP3.63
Rot. Bonds6

About 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide

4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide (PubChem CID 167909594) has the molecular formula C20H17N3O5S and a molecular weight of 411.44 g/mol. Its IUPAC name is 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide
PubChem CID167909594
Molecular FormulaC20H17N3O5S
Molecular Weight411.44 g/mol
Exact Mass411.09
IUPAC Name4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide
SMILESO=C1OCCN1c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cn2)cc1
InChIInChI=1S/C20H17N3O5S/c24-20-23(12-13-27-20)15-6-9-18(10-7-15)29(25,26)22-19-11-8-17(14-21-19)28-16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,21,22)
InChIKeyGLKSUYYDBOPYAV-UHFFFAOYSA-N
XLogP3.63
TPSA97.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.44
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-ethoxyphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372370
N-(2-methoxy-5-methylphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372372
[4-[[6-[(4-methylphenyl)sulfonylamino]-3-pyridinyl]oxy]phenyl]carbamic acid
CID 68999729
N-(4-acetylphenyl)-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372382
N-[2-(2-methoxyphenyl)ethyl]-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372328
4-(2,5-dioxopyrrolidin-1-yl)-N-(2-phenoxypyrimidin-5-yl)benzenesulfonamide
CID 122302540
(E)-N-(5-phenoxy-2-pyridinyl)-2-phenylethenesulfonamide
CID 86904914
4-cyclopentyloxy-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024414
N-[(4-fluorophenyl)methyl]-4-(2-oxo-1,3-oxazolidin-3-yl)benzenesulfonamide
CID 110372318
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113026209
N-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyridinyl]benzenesulfonamide
CID 113028143
N-(5-amino-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 43327268

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide (CID 167909594) is 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide is O=C1OCCN1c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cn2)cc1.
What is the InChIKey of 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide?
The InChIKey is GLKSUYYDBOPYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O5S/c24-20-23(12-13-27-20)15-6-9-18(10-7-15)29(25,26)22-19-11-8-17(14-21-19)28-16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,21,22).
What are the key properties of 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide?
4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide has a molecular weight of 411.44 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxo-1,3-oxazolidin-3-yl)-N-(5-phenoxy-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 167909594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).