2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide

C15H14ClFN2O5S2 — CID 24677242

IUPAC2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide
SMILESCS(=O)(=O)Nc1cc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)ccc1F
InChIInChI=1S/C15H14ClFN2O5S2/c1-25(21,22)19-14-8-11(4-7-13(14)17)18-15(20)9-26(23,24)12-5-2-10(16)3-6-12/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyAKAWMQVESXDSLV-UHFFFAOYSA-N
MW420.87 g/mol
LogP2.26
Rot. Bonds6

About 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide

2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide (PubChem CID 24677242) has the molecular formula C15H14ClFN2O5S2 and a molecular weight of 420.87 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide
PubChem CID24677242
Molecular FormulaC15H14ClFN2O5S2
Molecular Weight420.87 g/mol
Exact Mass420.00
IUPAC Name2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide
SMILESCS(=O)(=O)Nc1cc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)ccc1F
InChIInChI=1S/C15H14ClFN2O5S2/c1-25(21,22)19-14-8-11(4-7-13(14)17)18-15(20)9-26(23,24)12-5-2-10(16)3-6-12/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyAKAWMQVESXDSLV-UHFFFAOYSA-N
XLogP2.26
TPSA109.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.87
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-chlorophenyl)-N-[4-fluoro-3-(methanesulfonamido)phenyl]propanamide
CID 43050377
N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
CID 35348603
5-chloro-2-fluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]benzamide
CID 25487071
N-[4-fluoro-3-(methanesulfonamido)phenyl]-4-hydroxybutanamide
CID 79201442
2-(4-chlorophenyl)sulfonyl-N-(3,5-dimethylphenyl)acetamide
CID 7544014
5-[4-fluoro-3-(methanesulfonamido)anilino]-5-oxopentanoic acid
CID 60941392
N-[4-fluoro-3-(methanesulfonamido)phenyl]-3-(propan-2-ylamino)propanamide
CID 60852910
2-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 27449078
N-(3,4-difluorophenyl)-2-(4-methoxyphenyl)sulfonylacetamide
CID 86992863
2,2,2-trifluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide
CID 62732998
ethyl N-[4-fluoro-3-(methanesulfonamido)phenyl]carbamate
CID 60728396
2-amino-2-ethyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]butanamide
CID 79814001

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide (CID 24677242) is 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide is CS(=O)(=O)Nc1cc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)ccc1F.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide?
The InChIKey is AKAWMQVESXDSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O5S2/c1-25(21,22)19-14-8-11(4-7-13(14)17)18-15(20)9-26(23,24)12-5-2-10(16)3-6-12/h2-8,19H,9H2,1H3,(H,18,20).
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide?
2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide has a molecular weight of 420.87 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide is sourced from PubChem (CID 24677242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).