4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide

C23H20ClN3O2S — CID 10173558

IUPAC4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide
SMILESO=S(=O)(NCC(c1ccccc1)n1ccnc1)c1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C23H20ClN3O2S/c24-21-10-6-18(7-11-21)19-8-12-22(13-9-19)30(28,29)26-16-23(27-15-14-25-17-27)20-4-2-1-3-5-20/h1-15,17,23,26H,16H2
InChIKeyQVMVWXVZAMSOQJ-UHFFFAOYSA-N
MW437.95 g/mol
LogP4.77
Rot. Bonds7

About 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide

4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide (PubChem CID 10173558) has the molecular formula C23H20ClN3O2S and a molecular weight of 437.95 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide
PubChem CID10173558
Molecular FormulaC23H20ClN3O2S
Molecular Weight437.95 g/mol
Exact Mass437.10
IUPAC Name4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide
SMILESO=S(=O)(NCC(c1ccccc1)n1ccnc1)c1ccc(-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C23H20ClN3O2S/c24-21-10-6-18(7-11-21)19-8-12-22(13-9-19)30(28,29)26-16-23(27-15-14-25-17-27)20-4-2-1-3-5-20/h1-15,17,23,26H,16H2
InChIKeyQVMVWXVZAMSOQJ-UHFFFAOYSA-N
XLogP4.77
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.95
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)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-[(2R)-2-phenyl-2-(4-phenyltriazol-1-yl)ethyl]benzenesulfonamide
CID 992047
4-chloro-N-[(2R)-2-(4-ethylpiperazin-1-yl)-2-phenylethyl]benzenesulfonamide
CID 92669850
4-chloro-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-ylethyl]benzenesulfonamide
CID 16806780
3-[4-[1-[(4-chlorophenyl)sulfonylamino]-5-imidazol-1-ylhexan-2-yl]phenyl]propanoic acid
CID 139688596
4-chloro-N-[(2S)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198405
4-chloro-N-[(2R)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198403
N-(2-imidazol-1-yl-2-phenylethyl)-2-methylpropan-1-amine
CID 62446817
4-methyl-N-(2-phenyl-2-piperidin-1-ylethyl)benzenesulfonamide
CID 2784014
4-chloro-N-[2-(4-methylphenyl)sulfanyl-2-phenylethyl]benzenesulfonamide
CID 4544366
N-(2-hydroxy-2-phenylethyl)-4-phenylbenzenesulfonamide
CID 3731751
N-[2-(4-chloroanilino)-2-(4-chlorophenyl)ethyl]-4-methylbenzenesulfonamide
CID 51356051

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide?
The IUPAC name of 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide (CID 10173558) is 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide.
What is the SMILES notation for 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide?
The canonical SMILES for 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide is O=S(=O)(NCC(c1ccccc1)n1ccnc1)c1ccc(-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide?
The InChIKey is QVMVWXVZAMSOQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClN3O2S/c24-21-10-6-18(7-11-21)19-8-12-22(13-9-19)30(28,29)26-16-23(27-15-14-25-17-27)20-4-2-1-3-5-20/h1-15,17,23,26H,16H2.
What are the key properties of 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide?
4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide has a molecular weight of 437.95 g/mol, XLogP of 4.77, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-N-(2-imidazol-1-yl-2-phenylethyl)benzenesulfonamide is sourced from PubChem (CID 10173558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).