N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide

C18H15ClN2O2S — CID 3264601

IUPACN'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide
SMILESO=C(NNc1cccc(Cl)c1)C(O)(c1ccccc1)c1cccs1
InChIInChI=1S/C18H15ClN2O2S/c19-14-8-4-9-15(12-14)20-21-17(22)18(23,16-10-5-11-24-16)13-6-2-1-3-7-13/h1-12,20,23H,(H,21,22)
InChIKeyIEKSGUYEBOKCPP-UHFFFAOYSA-N
MW358.85 g/mol
LogP3.78
Rot. Bonds5

About N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide

N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide (PubChem CID 3264601) has the molecular formula C18H15ClN2O2S and a molecular weight of 358.85 g/mol. Its IUPAC name is N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide.

Molecular Properties

Compound NameN'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide
PubChem CID3264601
Molecular FormulaC18H15ClN2O2S
Molecular Weight358.85 g/mol
Exact Mass358.05
IUPAC NameN'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide
SMILESO=C(NNc1cccc(Cl)c1)C(O)(c1ccccc1)c1cccs1
InChIInChI=1S/C18H15ClN2O2S/c19-14-8-4-9-15(12-14)20-21-17(22)18(23,16-10-5-11-24-16)13-6-2-1-3-7-13/h1-12,20,23H,(H,21,22)
InChIKeyIEKSGUYEBOKCPP-UHFFFAOYSA-N
XLogP3.78
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.85
LogP ≤ 53.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3-chloroanilino)carbamic acid
CID 23031912
N-(3-chlorophenyl)-3,3,3-trifluoro-2-hydroxy-2-phenylpropanamide
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2-hydroxy-N',2,2-tris(3-methylphenyl)acetohydrazide
CID 4016272
1-(3-chlorophenyl)-2,2,3,3,3-pentafluoro-1-thiophen-2-ylpropan-1-ol
CID 162511359
N-[3-[chloro(difluoro)methyl]phenyl]-2-methyl-2-thiophen-2-ylpropanamide
CID 139604604
N'-(2-hydroxy-2-phenyl-2-thiophen-2-ylacetyl)-N-(3-methylphenyl)benzohydrazide
CID 3734254
2-hydroxy-2-(2-methoxyphenyl)-N'-(4-methylphenyl)-2-thiophen-2-ylacetohydrazide
CID 3479153
1-(4-chlorophenyl)-3-[(2-hydroxy-2,2-diphenylacetyl)amino]urea
CID 4130294
2-hydroxy-2,2-diphenyl-N'-[phenyl(thiophen-2-yl)methyl]acetohydrazide
CID 3780877
1-(3-chloroanilino)-3-phenylthiourea
CID 57269014
methyl 2-(3-chloroanilino)-2-phenylpropanoate
CID 60991426
N-(2-hydroxy-2-phenylpropyl)-2-methyl-2-thiophen-2-ylpropanamide
CID 111825074

Frequently Asked Questions

What is the IUPAC name of N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide?
The IUPAC name of N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide (CID 3264601) is N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide.
What is the SMILES notation for N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide?
The canonical SMILES for N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide is O=C(NNc1cccc(Cl)c1)C(O)(c1ccccc1)c1cccs1.
What is the InChIKey of N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide?
The InChIKey is IEKSGUYEBOKCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2S/c19-14-8-4-9-15(12-14)20-21-17(22)18(23,16-10-5-11-24-16)13-6-2-1-3-7-13/h1-12,20,23H,(H,21,22).
What are the key properties of N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide?
N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide has a molecular weight of 358.85 g/mol, XLogP of 3.78, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-chlorophenyl)-2-hydroxy-2-phenyl-2-thiophen-2-ylacetohydrazide is sourced from PubChem (CID 3264601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).