2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide

C19H15Cl2NO4S — CID 90488956

IUPAC2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide
SMILESCOc1ccc(-c2ccccc2)c(NS(=O)(=O)c2cc(O)c(Cl)cc2Cl)c1
InChIInChI=1S/C19H15Cl2NO4S/c1-26-13-7-8-14(12-5-3-2-4-6-12)17(9-13)22-27(24,25)19-11-18(23)15(20)10-16(19)21/h2-11,22-23H,1H3
InChIKeyLIZVMVYXZWADCK-UHFFFAOYSA-N
MW424.31 g/mol
LogP5.18
Rot. Bonds5

About 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide

2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide (PubChem CID 90488956) has the molecular formula C19H15Cl2NO4S and a molecular weight of 424.31 g/mol. Its IUPAC name is 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide
PubChem CID90488956
Molecular FormulaC19H15Cl2NO4S
Molecular Weight424.31 g/mol
Exact Mass423.01
IUPAC Name2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide
SMILESCOc1ccc(-c2ccccc2)c(NS(=O)(=O)c2cc(O)c(Cl)cc2Cl)c1
InChIInChI=1S/C19H15Cl2NO4S/c1-26-13-7-8-14(12-5-3-2-4-6-12)17(9-13)22-27(24,25)19-11-18(23)15(20)10-16(19)21/h2-11,22-23H,1H3
InChIKeyLIZVMVYXZWADCK-UHFFFAOYSA-N
XLogP5.18
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.31
LogP ≤ 55.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methoxy-2-phenylphenyl)-4-methylbenzenesulfonamide
CID 169370137
N-(2-chloro-5-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 47408334
N-(3-chloro-4-hydroxynaphthalen-1-yl)-2,5-dimethoxybenzenesulfonamide
CID 58565637
N-[4,5-dichloro-2-[(2-hydroxy-5-methoxyphenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 118101197
5-methoxy-2-phenylphenol;propan-2-one
CID 175099013
2,4-dichloro-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid
CID 992252
4-chloro-2,5-dimethyl-N-(2-phenylphenyl)benzenesulfonamide
CID 19684190
3,5-dichloro-2-hydroxy-N-(2-methoxy-4-phenylphenyl)benzenesulfonamide
CID 146545964
4-bromo-2-chloro-N-(2,4-dimethoxyphenyl)benzenesulfonamide
CID 7514398
N-(2-chloro-4-methoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 60597504
2,4-difluoro-N-(2-hydroxy-5-methoxyphenyl)benzenesulfonamide
CID 103760220
N-(5-chloro-4-fluoro-2-hydroxyphenyl)-4-methoxybenzenesulfonamide
CID 82721249

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide?
The IUPAC name of 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide (CID 90488956) is 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide.
What is the SMILES notation for 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide?
The canonical SMILES for 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide is COc1ccc(-c2ccccc2)c(NS(=O)(=O)c2cc(O)c(Cl)cc2Cl)c1.
What is the InChIKey of 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide?
The InChIKey is LIZVMVYXZWADCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO4S/c1-26-13-7-8-14(12-5-3-2-4-6-12)17(9-13)22-27(24,25)19-11-18(23)15(20)10-16(19)21/h2-11,22-23H,1H3.
What are the key properties of 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide?
2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide has a molecular weight of 424.31 g/mol, XLogP of 5.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-hydroxy-N-(5-methoxy-2-phenylphenyl)benzenesulfonamide is sourced from PubChem (CID 90488956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).