N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide

C18H24ClN3OS — CID 2718859

IUPACN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide
SMILESCCCCCCCCC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C18H24ClN3OS/c1-2-3-4-5-6-7-8-17(23)21-22-18-20-16(13-24-18)14-9-11-15(19)12-10-14/h9-13H,2-8H2,1H3,(H,20,22)(H,21,23)
InChIKeyPABWEMWAWJXBSF-UHFFFAOYSA-N
MW365.93 g/mol
LogP5.66
Rot. Bonds10

About N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide

N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide (PubChem CID 2718859) has the molecular formula C18H24ClN3OS and a molecular weight of 365.93 g/mol. Its IUPAC name is N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide.

Molecular Properties

Compound NameN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide
PubChem CID2718859
Molecular FormulaC18H24ClN3OS
Molecular Weight365.93 g/mol
Exact Mass365.13
IUPAC NameN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide
SMILESCCCCCCCCC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C18H24ClN3OS/c1-2-3-4-5-6-7-8-17(23)21-22-18-20-16(13-24-18)14-9-11-15(19)12-10-14/h9-13H,2-8H2,1H3,(H,20,22)(H,21,23)
InChIKeyPABWEMWAWJXBSF-UHFFFAOYSA-N
XLogP5.66
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.93
LogP ≤ 55.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-phenyl-1,3-thiazol-2-yl)hexadecanehydrazide
CID 5068423
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]decanamide
CID 4302943
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide
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N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]hexadecanamide
CID 4161318
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N',N'-diethylpentanediamide
CID 56521362
N-[3-[2-(4-chloroanilino)-1,3-thiazol-4-yl]phenyl]octanamide
CID 5216456
N-[4-[2-(3-chloroanilino)-1,3-thiazol-4-yl]phenyl]heptanamide
CID 3553749
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]hexanamide
CID 18083975
4-(4-chlorophenoxy)-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]butanamide
CID 19184059
N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]pentanamide
CID 108748145
N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)octadecanamide
CID 108733431
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-methoxybenzohydrazide
CID 1497726

Frequently Asked Questions

What is the IUPAC name of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide?
The IUPAC name of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide (CID 2718859) is N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide.
What is the SMILES notation for N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide?
The canonical SMILES for N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide is CCCCCCCCC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1.
What is the InChIKey of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide?
The InChIKey is PABWEMWAWJXBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24ClN3OS/c1-2-3-4-5-6-7-8-17(23)21-22-18-20-16(13-24-18)14-9-11-15(19)12-10-14/h9-13H,2-8H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide?
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide has a molecular weight of 365.93 g/mol, XLogP of 5.66, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide is sourced from PubChem (CID 2718859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).