N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide

C23H22N4O6S — CID 175417940

IUPACN-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide
SMILESO=C1COCCN1c1ccc(N2C[C@H](CNS(=O)(=O)c3cccc4cccnc34)OC2=O)cc1
InChIInChI=1S/C23H22N4O6S/c28-21-15-32-12-11-26(21)17-6-8-18(9-7-17)27-14-19(33-23(27)29)13-25-34(30,31)20-5-1-3-16-4-2-10-24-22(16)20/h1-10,19,25H,11-15H2/t19-/m0/s1
InChIKeyBKYCUUYCNNOBLR-IBGZPJMESA-N
MW482.52 g/mol
LogP1.90
Rot. Bonds6

About N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide

N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide (PubChem CID 175417940) has the molecular formula C23H22N4O6S and a molecular weight of 482.52 g/mol. Its IUPAC name is N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide
PubChem CID175417940
Molecular FormulaC23H22N4O6S
Molecular Weight482.52 g/mol
Exact Mass482.13
IUPAC NameN-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide
SMILESO=C1COCCN1c1ccc(N2C[C@H](CNS(=O)(=O)c3cccc4cccnc34)OC2=O)cc1
InChIInChI=1S/C23H22N4O6S/c28-21-15-32-12-11-26(21)17-6-8-18(9-7-17)27-14-19(33-23(27)29)13-25-34(30,31)20-5-1-3-16-4-2-10-24-22(16)20/h1-10,19,25H,11-15H2/t19-/m0/s1
InChIKeyBKYCUUYCNNOBLR-IBGZPJMESA-N
XLogP1.90
TPSA118.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.52
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide with MolForge

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Related Compounds

N-(4-morpholin-4-ylsulfonylphenyl)-2-quinolin-8-ylsulfanylacetamide
CID 4261263
Ethyl 4-[(1-quinolin-8-ylsulfonylpiperidine-4-carbonyl)amino]piperidine-1-carboxylate
CID 5308545
N-(oxolan-2-ylmethyl)-1-quinolin-8-ylsulfonylpiperidine-4-carboxamide
CID 5309304
4-(Quinoline-8-sulfonyl)-piperazine-1-carboxylic acid ethyl ester
CID 648962
N-[2-(4-morpholinylcarbonyl)phenyl]-8-quinolinesulfonamide
CID 1179220
N-[[(5R)-3-(3-fluoro-4-morpholino-phenyl)-2-oxo-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide
CID 71652736
N-(1-{1,4-Dioxa-8-azaspiro[4.5]decan-8-YL}-1-oxo-3-phenylpropan-2-YL)quinoline-8-sulfonamide
CID 20950520
N-[1-(Morpholin-4-YL)-1-oxo-3-phenylpropan-2-YL]quinoline-8-sulfonamide
CID 20950530
N-[[(5R)-3-(3-fluoro-4-thiomorpholino-phenyl)-2-oxo-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide
CID 71653187
2-ethoxy-N-(3-methylquinolin-8-yl)sulfonylpropanamide
CID 71940251
Ethyl 4-(quinolin-8-ylsulfonylamino)piperidine-1-carboxylate
CID 172437173
N-[(2R)-1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]quinoline-8-sulfonamide
CID 110201017

Frequently Asked Questions

What is the IUPAC name of N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide?
The IUPAC name of N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide (CID 175417940) is N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide.
What is the SMILES notation for N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide?
The canonical SMILES for N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide is O=C1COCCN1c1ccc(N2C[C@H](CNS(=O)(=O)c3cccc4cccnc34)OC2=O)cc1.
What is the InChIKey of N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide?
The InChIKey is BKYCUUYCNNOBLR-IBGZPJMESA-N. The full InChI is InChI=1S/C23H22N4O6S/c28-21-15-32-12-11-26(21)17-6-8-18(9-7-17)27-14-19(33-23(27)29)13-25-34(30,31)20-5-1-3-16-4-2-10-24-22(16)20/h1-10,19,25H,11-15H2/t19-/m0/s1.
What are the key properties of N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide?
N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide has a molecular weight of 482.52 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]quinoline-8-sulfonamide is sourced from PubChem (CID 175417940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).