2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide

C15H15Cl2NO3S — CID 146256312

IUPAC2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
SMILESCc1ccccc1CCNS(=O)(=O)c1c(O)cc(Cl)cc1Cl
InChIInChI=1S/C15H15Cl2NO3S/c1-10-4-2-3-5-11(10)6-7-18-22(20,21)15-13(17)8-12(16)9-14(15)19/h2-5,8-9,18-19H,6-7H2,1H3
InChIKeySXVGSXWKOSNYBF-UHFFFAOYSA-N
MW360.26 g/mol
LogP3.53
Rot. Bonds5

About 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide

2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide (PubChem CID 146256312) has the molecular formula C15H15Cl2NO3S and a molecular weight of 360.26 g/mol. Its IUPAC name is 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
PubChem CID146256312
Molecular FormulaC15H15Cl2NO3S
Molecular Weight360.26 g/mol
Exact Mass359.01
IUPAC Name2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
SMILESCc1ccccc1CCNS(=O)(=O)c1c(O)cc(Cl)cc1Cl
InChIInChI=1S/C15H15Cl2NO3S/c1-10-4-2-3-5-11(10)6-7-18-22(20,21)15-13(17)8-12(16)9-14(15)19/h2-5,8-9,18-19H,6-7H2,1H3
InChIKeySXVGSXWKOSNYBF-UHFFFAOYSA-N
XLogP3.53
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.26
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-6-chloro-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 79756335
2-chloro-N-[2-(2-chlorophenyl)ethyl]-6-methylbenzenesulfonamide
CID 146256445
2-amino-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 22722440
2-chloro-N-[2-(2-methylphenyl)ethyl]pyrimidine-5-sulfonamide
CID 79763049
5-amino-2-fluoro-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 79756333
2-chloro-N-[2-(2,4-dimethylphenyl)ethyl]benzenesulfonamide
CID 3685302
5-amino-2-methyl-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 78984276
3-chloro-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605350
3,5-dichloro-N-[2-(2,4-dimethylphenyl)ethyl]benzenesulfonamide
CID 3669015
5-(aminomethyl)-2-bromo-N-[2-(2-methylphenyl)ethyl]thiophene-3-sulfonamide
CID 106070776
3-[(2-chlorophenyl)sulfonylamino]-N-methyl-N-[(2-methylphenyl)methyl]propanamide
CID 51161411
N-[2-(2-hydroxyphenyl)ethyl]-4-methoxy-2-methylbenzenesulfonamide
CID 110605307

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide?
The IUPAC name of 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide (CID 146256312) is 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide?
The canonical SMILES for 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide is Cc1ccccc1CCNS(=O)(=O)c1c(O)cc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide?
The InChIKey is SXVGSXWKOSNYBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO3S/c1-10-4-2-3-5-11(10)6-7-18-22(20,21)15-13(17)8-12(16)9-14(15)19/h2-5,8-9,18-19H,6-7H2,1H3.
What are the key properties of 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide?
2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide has a molecular weight of 360.26 g/mol, XLogP of 3.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-hydroxy-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide is sourced from PubChem (CID 146256312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).