2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide

C16H11Cl2N3O2S — CID 10667452

IUPAC2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide
SMILESO=C(Nc1nsnc1-c1ccc(Cl)cc1)C(O)c1ccc(Cl)cc1
InChIInChI=1S/C16H11Cl2N3O2S/c17-11-5-1-9(2-6-11)13-15(21-24-20-13)19-16(23)14(22)10-3-7-12(18)8-4-10/h1-8,14,22H,(H,19,21,23)
InChIKeyPUORYNJUTCMBHV-UHFFFAOYSA-N
MW380.26 g/mol
LogP4.18
Rot. Bonds4

About 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide

2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide (PubChem CID 10667452) has the molecular formula C16H11Cl2N3O2S and a molecular weight of 380.26 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide
PubChem CID10667452
Molecular FormulaC16H11Cl2N3O2S
Molecular Weight380.26 g/mol
Exact Mass378.99
IUPAC Name2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide
SMILESO=C(Nc1nsnc1-c1ccc(Cl)cc1)C(O)c1ccc(Cl)cc1
InChIInChI=1S/C16H11Cl2N3O2S/c17-11-5-1-9(2-6-11)13-15(21-24-20-13)19-16(23)14(22)10-3-7-12(18)8-4-10/h1-8,14,22H,(H,19,21,23)
InChIKeyPUORYNJUTCMBHV-UHFFFAOYSA-N
XLogP4.18
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.26
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-chlorophenyl)phenyl]-2-hydroxyacetic acid
CID 19793104
N-[4-(2,6-dichlorophenyl)-1,2,5-thiadiazol-3-yl]-2-methylpropanamide
CID 15023188
(2S)-2-(4-chlorophenyl)-2-hydroxyacetic acid
CID 785083
4-(4-chlorophenyl)-1,2,5-thiadiazol-3-amine
CID 11820477
3-(4-chlorophenyl)-4-(2,6-dichlorophenyl)-1,2,5-thiadiazole
CID 15252600
4-(4-chlorophenyl)-N-[(2R)-2-hydroxy-2-phenylacetyl]benzamide
CID 22872207
(2R)-2-(4-chlorophenyl)-2-hydroxyacetamide
CID 69300221
2-(4-chlorophenyl)-2-hydroxy-N-[5-(1H-indazol-5-yl)-3-pyridinyl]acetamide
CID 117074203
(2S)-2-(4-chlorophenyl)-N-methylpropanamide
CID 143748208
2-(4-chlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-hydroxyacetamide
CID 154862984
2-(4-chlorophenyl)-2-hydroxy-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide;2,2,2-trifluoroacetic acid
CID 117074114
2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]-2-oxoacetamide
CID 159064937

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide (CID 10667452) is 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide is O=C(Nc1nsnc1-c1ccc(Cl)cc1)C(O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide?
The InChIKey is PUORYNJUTCMBHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2N3O2S/c17-11-5-1-9(2-6-11)13-15(21-24-20-13)19-16(23)14(22)10-3-7-12(18)8-4-10/h1-8,14,22H,(H,19,21,23).
What are the key properties of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide?
2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide has a molecular weight of 380.26 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-thiadiazol-3-yl]-2-hydroxyacetamide is sourced from PubChem (CID 10667452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).