2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide

C14H14N2O3S2 — CID 78992086

IUPAC2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccccc1NC(=O)CSc1ccccc1
InChIInChI=1S/C14H14N2O3S2/c15-21(18,19)13-9-5-4-8-12(13)16-14(17)10-20-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)(H2,15,18,19)
InChIKeyRZNFCFAUFXVAMY-UHFFFAOYSA-N
MW322.41 g/mol
LogP2.06
Rot. Bonds5

About 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide

2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide (PubChem CID 78992086) has the molecular formula C14H14N2O3S2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide
PubChem CID78992086
Molecular FormulaC14H14N2O3S2
Molecular Weight322.41 g/mol
Exact Mass322.04
IUPAC Name2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccccc1NC(=O)CSc1ccccc1
InChIInChI=1S/C14H14N2O3S2/c15-21(18,19)13-9-5-4-8-12(13)16-14(17)10-20-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)(H2,15,18,19)
InChIKeyRZNFCFAUFXVAMY-UHFFFAOYSA-N
XLogP2.06
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyphenyl)-2-phenylsulfanylacetamide
CID 893908
4-oxo-4-(2-sulfamoylanilino)butanoic acid
CID 61129519
3-amino-N-(2-sulfamoylphenyl)propanamide
CID 10705385
2-(2-phenylsulfanylethylamino)benzenesulfonamide;hydrochloride
CID 142779207
N-[2-[(2-phenylsulfanylacetyl)amino]phenyl]butanamide
CID 895128
2-phenylsulfanylacetohydrazide
CID 7037418
3-methyl-5-oxo-5-(2-sulfamoylanilino)pentanoic acid
CID 62964751
2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-(2-sulfamoylphenyl)acetamide
CID 5275084
3-phenyl-N-(2-sulfamoylphenyl)prop-2-ynamide
CID 61129572
N-(2-hydroxy-4-methylphenyl)-2-phenylsulfanylacetamide
CID 6460145
2-cyclobutyl-N-(2-sulfamoylphenyl)acetamide
CID 103166193
2-phenylsulfanyl-N-(2-prop-2-enylphenyl)acetamide
CID 15268776

Frequently Asked Questions

What is the IUPAC name of 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide?
The IUPAC name of 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide (CID 78992086) is 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide is NS(=O)(=O)c1ccccc1NC(=O)CSc1ccccc1.
What is the InChIKey of 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide?
The InChIKey is RZNFCFAUFXVAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S2/c15-21(18,19)13-9-5-4-8-12(13)16-14(17)10-20-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)(H2,15,18,19).
What are the key properties of 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide?
2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide has a molecular weight of 322.41 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide is sourced from PubChem (CID 78992086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).