4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide

C20H20ClN3O2S — CID 51567307

IUPAC4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide
SMILESO=S(=O)(NC[C@H](NNc1ccccc1)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H20ClN3O2S/c21-17-11-13-19(14-12-17)27(25,26)22-15-20(16-7-3-1-4-8-16)24-23-18-9-5-2-6-10-18/h1-14,20,22-24H,15H2/t20-/m0/s1
InChIKeySUXMXWRFCODOFJ-FQEVSTJZSA-N
MW401.92 g/mol
LogP3.98
Rot. Bonds8

About 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide

4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide (PubChem CID 51567307) has the molecular formula C20H20ClN3O2S and a molecular weight of 401.92 g/mol. Its IUPAC name is 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide
PubChem CID51567307
Molecular FormulaC20H20ClN3O2S
Molecular Weight401.92 g/mol
Exact Mass401.10
IUPAC Name4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide
SMILESO=S(=O)(NC[C@H](NNc1ccccc1)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H20ClN3O2S/c21-17-11-13-19(14-12-17)27(25,26)22-15-20(16-7-3-1-4-8-16)24-23-18-9-5-2-6-10-18/h1-14,20,22-24H,15H2/t20-/m0/s1
InChIKeySUXMXWRFCODOFJ-FQEVSTJZSA-N
XLogP3.98
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.92
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide 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

4-chloro-N-[(2S)-2-[4-[(1S)-2-[(4-chlorophenyl)sulfonylamino]-1-phenylethyl]piperazin-1-yl]-2-phenylethyl]benzenesulfonamide
CID 7067570
4-chloro-N-[(2S)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198405
4-chloro-N-[(2R)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198403
N-[2-(4-chloroanilino)-2-(4-chlorophenyl)ethyl]-4-methylbenzenesulfonamide
CID 51356051
N-[(2S)-2-(benzhydrylamino)-2-phenylethyl]benzenesulfonamide
CID 1230083
4-chloro-N-phenylbenzenesulfonamide;ethane
CID 91229233
2-(4-chlorophenyl)sulfonyl-N-methyl-1-phenylethanamine
CID 64640001
N-[2,3-bis(4-chlorophenyl)butyl]benzenesulfonamide
CID 69331280
4-chloro-N-[2-(4-methylphenyl)sulfanyl-2-phenylethyl]benzenesulfonamide
CID 4544366
4-chloro-N-[(2R)-2-(4-ethylpiperazin-1-yl)-2-phenylethyl]benzenesulfonamide
CID 92669850
N-[(2R)-2-anilino-2-(2-chlorophenyl)ethyl]-4-methylbenzenesulfonamide
CID 71663028
4-chloro-N-(2-hydroxy-3-phenoxypropyl)benzenesulfonamide
CID 166232814

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide?
The IUPAC name of 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide (CID 51567307) is 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide is O=S(=O)(NC[C@H](NNc1ccccc1)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide?
The InChIKey is SUXMXWRFCODOFJ-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H20ClN3O2S/c21-17-11-13-19(14-12-17)27(25,26)22-15-20(16-7-3-1-4-8-16)24-23-18-9-5-2-6-10-18/h1-14,20,22-24H,15H2/t20-/m0/s1.
What are the key properties of 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide?
4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide has a molecular weight of 401.92 g/mol, XLogP of 3.98, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(2R)-2-phenyl-2-(2-phenylhydrazinyl)ethyl]benzenesulfonamide is sourced from PubChem (CID 51567307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).