6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen

C14H24N4O7S — CID 142490492

IUPAC6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen
SMILESCC.CS(O)(O)OCCC1CN(c2cnc3c(n2)NC(=O)CO3)C(=O)O1.[H][H]
InChIInChI=1S/C12H16N4O7S.C2H6.H2/c1-24(19,20)22-3-2-7-5-16(12(18)23-7)8-4-13-11-10(14-8)15-9(17)6-21-11;1-2;/h4,7,19-20H,2-3,5-6H2,1H3,(H,14,15,17);1-2H3;1H
InChIKeyYGALFWYNHGHCPT-UHFFFAOYSA-N
MW392.43 g/mol
LogP2.11
Rot. Bonds5

About 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen

6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen (PubChem CID 142490492) has the molecular formula C14H24N4O7S and a molecular weight of 392.43 g/mol. Its IUPAC name is 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen.

Molecular Properties

Compound Name6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen
PubChem CID142490492
Molecular FormulaC14H24N4O7S
Molecular Weight392.43 g/mol
Exact Mass392.14
IUPAC Name6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen
SMILESCC.CS(O)(O)OCCC1CN(c2cnc3c(n2)NC(=O)CO3)C(=O)O1.[H][H]
InChIInChI=1S/C12H16N4O7S.C2H6.H2/c1-24(19,20)22-3-2-7-5-16(12(18)23-7)8-4-13-11-10(14-8)15-9(17)6-21-11;1-2;/h4,7,19-20H,2-3,5-6H2,1H3,(H,14,15,17);1-2H3;1H
InChIKeyYGALFWYNHGHCPT-UHFFFAOYSA-N
XLogP2.11
TPSA143.34 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen?
The IUPAC name of 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen (CID 142490492) is 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen.
What is the SMILES notation for 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen?
The canonical SMILES for 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen is CC.CS(O)(O)OCCC1CN(c2cnc3c(n2)NC(=O)CO3)C(=O)O1.[H][H].
What is the InChIKey of 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen?
The InChIKey is YGALFWYNHGHCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O7S.C2H6.H2/c1-24(19,20)22-3-2-7-5-16(12(18)23-7)8-4-13-11-10(14-8)15-9(17)6-21-11;1-2;/h4,7,19-20H,2-3,5-6H2,1H3,(H,14,15,17);1-2H3;1H.
What are the key properties of 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen?
6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen has a molecular weight of 392.43 g/mol, XLogP of 2.11, 5 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-[2-[dihydroxy(methyl)-λ4-sulfanyl]oxyethyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrazino[2,3-b][1,4]oxazin-3-one;ethane;molecular hydrogen is sourced from PubChem (CID 142490492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).