5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide

C19H21ClN4O5S2 — CID 139958675

IUPAC5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
SMILESO=C(NCC1CN(c2ccc(S(=O)(=O)N3CCNCC3)cc2)C(=O)O1)c1ccc(Cl)s1
InChIInChI=1S/C19H21ClN4O5S2/c20-17-6-5-16(30-17)18(25)22-11-14-12-24(19(26)29-14)13-1-3-15(4-2-13)31(27,28)23-9-7-21-8-10-23/h1-6,14,21H,7-12H2,(H,22,25)
InChIKeyWKUICQNOLHQZHY-UHFFFAOYSA-N
MW484.99 g/mol
LogP1.75
Rot. Bonds6

About 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide

5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide (PubChem CID 139958675) has the molecular formula C19H21ClN4O5S2 and a molecular weight of 484.99 g/mol. Its IUPAC name is 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
PubChem CID139958675
Molecular FormulaC19H21ClN4O5S2
Molecular Weight484.99 g/mol
Exact Mass484.06
IUPAC Name5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
SMILESO=C(NCC1CN(c2ccc(S(=O)(=O)N3CCNCC3)cc2)C(=O)O1)c1ccc(Cl)s1
InChIInChI=1S/C19H21ClN4O5S2/c20-17-6-5-16(30-17)18(25)22-11-14-12-24(19(26)29-14)13-1-3-15(4-2-13)31(27,28)23-9-7-21-8-10-23/h1-6,14,21H,7-12H2,(H,22,25)
InChIKeyWKUICQNOLHQZHY-UHFFFAOYSA-N
XLogP1.75
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.99
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-[[(5S)-3-[4-(dimethylsulfamoyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 57496659
5-chloro-N-[[(5S)-2-oxo-3-(4-pyrrolidin-1-ylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 10158209
5-chloro-N-[[3-(3-fluoro-4-piperazin-1-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 21070746
5-chloro-N-[[(5S)-2-oxo-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 10202260
5-chloro-N-[[3-[4-(5,6-dihydro-1H-1,2,4-triazin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 74930687
5-chloro-N-[[3-[4-(5,6-dihydro-2H-1,2,4-triazin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 66892669
5-chloro-N-[[3-[4-(methoxyamino)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 142207900
5-chloro-N-[[2-oxo-3-[4-(2-oxo-1-pyridinyl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 58618158
5-chloro-N-[[3-[4-(2-hydroxyethylamino)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 72539282
N-[[3-[4-[(carbamoylamino)methyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]-5-chlorothiophene-2-carboxamide
CID 21070785
5-chloro-N-[[3-(3-chloro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 21070740
5-chloro-N-[[3-[4-(1,3-dimethyl-5,6-dihydro-1,2,4-triazin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide
CID 74930689

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide (CID 139958675) is 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide is O=C(NCC1CN(c2ccc(S(=O)(=O)N3CCNCC3)cc2)C(=O)O1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?
The InChIKey is WKUICQNOLHQZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O5S2/c20-17-6-5-16(30-17)18(25)22-11-14-12-24(19(26)29-14)13-1-3-15(4-2-13)31(27,28)23-9-7-21-8-10-23/h1-6,14,21H,7-12H2,(H,22,25).
What are the key properties of 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide?
5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide has a molecular weight of 484.99 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[[2-oxo-3-(4-piperazin-1-ylsulfonylphenyl)-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 139958675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).