N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide

C20H18N2O3S2 — CID 2207163

IUPACN-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2Sc2ccccc2)cc1
InChIInChI=1S/C20H18N2O3S2/c1-15(23)21-16-11-13-18(14-12-16)27(24,25)22-19-9-5-6-10-20(19)26-17-7-3-2-4-8-17/h2-14,22H,1H3,(H,21,23)
InChIKeyRZLGQNYMKBVMHA-UHFFFAOYSA-N
MW398.51 g/mol
LogP4.60
Rot. Bonds6

About N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide

N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide (PubChem CID 2207163) has the molecular formula C20H18N2O3S2 and a molecular weight of 398.51 g/mol. Its IUPAC name is N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide
PubChem CID2207163
Molecular FormulaC20H18N2O3S2
Molecular Weight398.51 g/mol
Exact Mass398.08
IUPAC NameN-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2Sc2ccccc2)cc1
InChIInChI=1S/C20H18N2O3S2/c1-15(23)21-16-11-13-18(14-12-16)27(24,25)22-19-9-5-6-10-20(19)26-17-7-3-2-4-8-17/h2-14,22H,1H3,(H,21,23)
InChIKeyRZLGQNYMKBVMHA-UHFFFAOYSA-N
XLogP4.60
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.51
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide 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

1-N-methyl-4-N-(2-phenylsulfanylphenyl)benzene-1,4-disulfonamide
CID 25331209
4-chloro-N-(2-phenylsulfanylphenyl)benzenesulfonamide
CID 2211474
4-fluoro-N-(2-phenylsulfanylphenyl)benzenesulfonamide
CID 2207449
2-[(4-acetamidophenyl)sulfonylamino]benzoic acid
CID 3863821
4-cyano-N-(2-phenylsulfanylphenyl)benzenesulfonamide
CID 4584042
2-[(4-acetamidophenyl)sulfonylamino]benzoate
CID 7040069
4-butyl-N-(2-phenylsulfanylphenyl)benzenesulfonamide
CID 22202239
N-(2-phenylsulfanylphenyl)naphthalene-2-sulfonamide
CID 5025961
N-[2-(4-chlorophenyl)sulfanylphenyl]-4-methylbenzenesulfonamide
CID 22202175
N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide
CID 730422
4-fluoro-N-[2-fluoro-4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]benzamide
CID 18893521
2-chloro-N-[2-fluoro-4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]benzamide
CID 18893032

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide (CID 2207163) is N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2Sc2ccccc2)cc1.
What is the InChIKey of N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is RZLGQNYMKBVMHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S2/c1-15(23)21-16-11-13-18(14-12-16)27(24,25)22-19-9-5-6-10-20(19)26-17-7-3-2-4-8-17/h2-14,22H,1H3,(H,21,23).
What are the key properties of N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide?
N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 398.51 g/mol, XLogP of 4.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-phenylsulfanylphenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 2207163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).