N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide

C21H19NO2S2 — CID 24944979

IUPACN-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide
SMILESCSc1ccc(-c2ccc(Sc3ccccc3CC(=O)NO)cc2)cc1
InChIInChI=1S/C21H19NO2S2/c1-25-18-10-6-15(7-11-18)16-8-12-19(13-9-16)26-20-5-3-2-4-17(20)14-21(23)22-24/h2-13,24H,14H2,1H3,(H,22,23)
InChIKeyGLTMNRBKOJOJOG-UHFFFAOYSA-N
MW381.52 g/mol
LogP5.27
Rot. Bonds6

About N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide

N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide (PubChem CID 24944979) has the molecular formula C21H19NO2S2 and a molecular weight of 381.52 g/mol. Its IUPAC name is N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide
PubChem CID24944979
Molecular FormulaC21H19NO2S2
Molecular Weight381.52 g/mol
Exact Mass381.09
IUPAC NameN-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide
SMILESCSc1ccc(-c2ccc(Sc3ccccc3CC(=O)NO)cc2)cc1
InChIInChI=1S/C21H19NO2S2/c1-25-18-10-6-15(7-11-18)16-8-12-19(13-9-16)26-20-5-3-2-4-17(20)14-21(23)22-24/h2-13,24H,14H2,1H3,(H,22,23)
InChIKeyGLTMNRBKOJOJOG-UHFFFAOYSA-N
XLogP5.27
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.52
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-2-[2-(4-prop-2-enoxyphenyl)sulfanylphenyl]acetamide
CID 143619207
S-[[2-(4-methylsulfanylphenyl)sulfanylphenyl]methyl] ethanethioate
CID 174369159
2-[2-(4-methylphenyl)sulfanylphenyl]acetic acid
CID 10706368
S-[[2-(4-methylsulfanylphenyl)sulfanylphenyl]methyl] prop-2-enethioate
CID 174369069
methyl 2-[2-(4-hydroxyphenyl)sulfanylphenyl]acetate
CID 18365028
2-[2-(4-acetamidophenyl)sulfanylphenyl]acetic acid
CID 23967352
benzyl 2-[2-(4-bromophenyl)sulfanylphenyl]acetate;benzyl 2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylphenyl]acetate;dichloromethane;N-hydroxy-2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylphenyl]acetamide;2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylphenyl]acetic acid;2-[2-[4-(4-methoxyphenyl)phenyl]sulfanylphenyl]-N-phenylmethoxyacetamide
CID 158698036
2-[2-(4-bromophenyl)sulfanylphenyl]-N-phenylmethoxyacetamide;dichloromethane;N-hydroxy-2-[2-(4-pyridin-4-ylphenyl)sulfanylphenyl]acetamide;N-phenylmethoxy-2-[2-(4-pyridin-4-ylphenyl)sulfanylphenyl]acetamide;pyridin-4-ylboronic acid
CID 161354031
N-hydroxy-2-(2-propan-2-ylphenyl)acetamide
CID 142619078
2-fluoro-6-[[2-(4-methylphenyl)sulfanylphenyl]methylamino]phenol
CID 69009203
N-hydroxy-4-[1-[[2-(2-methylsulfanylphenyl)acetyl]amino]ethyl]benzamide
CID 123886704
1-bromo-4-(2-ethylphenyl)sulfanylbenzene;ethane
CID 143619188

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide?
The IUPAC name of N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide (CID 24944979) is N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide.
What is the SMILES notation for N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide?
The canonical SMILES for N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide is CSc1ccc(-c2ccc(Sc3ccccc3CC(=O)NO)cc2)cc1.
What is the InChIKey of N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide?
The InChIKey is GLTMNRBKOJOJOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2S2/c1-25-18-10-6-15(7-11-18)16-8-12-19(13-9-16)26-20-5-3-2-4-17(20)14-21(23)22-24/h2-13,24H,14H2,1H3,(H,22,23).
What are the key properties of N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide?
N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide has a molecular weight of 381.52 g/mol, XLogP of 5.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-[4-(4-methylsulfanylphenyl)phenyl]sulfanylphenyl]acetamide is sourced from PubChem (CID 24944979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).