4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide

C16H11Cl3N4OS — CID 26720800

IUPAC4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide
SMILESCc1nc(-c2ccccn2)sc1C(=O)NNc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C16H11Cl3N4OS/c1-8-14(25-16(21-8)12-4-2-3-5-20-12)15(24)23-22-13-10(18)6-9(17)7-11(13)19/h2-7,22H,1H3,(H,23,24)
InChIKeyLYKIWVNDKMNBTN-UHFFFAOYSA-N
MW413.72 g/mol
LogP5.23
Rot. Bonds4

About 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide

4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide (PubChem CID 26720800) has the molecular formula C16H11Cl3N4OS and a molecular weight of 413.72 g/mol. Its IUPAC name is 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound Name4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide
PubChem CID26720800
Molecular FormulaC16H11Cl3N4OS
Molecular Weight413.72 g/mol
Exact Mass411.97
IUPAC Name4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide
SMILESCc1nc(-c2ccccn2)sc1C(=O)NNc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C16H11Cl3N4OS/c1-8-14(25-16(21-8)12-4-2-3-5-20-12)15(24)23-22-13-10(18)6-9(17)7-11(13)19/h2-7,22H,1H3,(H,23,24)
InChIKeyLYKIWVNDKMNBTN-UHFFFAOYSA-N
XLogP5.23
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.72
LogP ≤ 55.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chlorophenyl)-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9138637
N-(3-chloro-4-fluorophenyl)-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9255638
N-[(4-chlorophenyl)methyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9138190
4-methyl-2-pyridin-2-yl-N-(pyridin-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 18107589
N-[(1S)-1-(4-chlorophenyl)propyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 41490350
N-benzyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9138512
4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide
CID 146710066
N'-(4-ethoxybenzoyl)-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carbohydrazide
CID 55405847
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 8927668
N-[2-chloro-5-(propanoylamino)phenyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 55799328
4-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 78816429
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carbohydrazide
CID 26782330

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide?
The IUPAC name of 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide (CID 26720800) is 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide is Cc1nc(-c2ccccn2)sc1C(=O)NNc1c(Cl)cc(Cl)cc1Cl.
What is the InChIKey of 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide?
The InChIKey is LYKIWVNDKMNBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl3N4OS/c1-8-14(25-16(21-8)12-4-2-3-5-20-12)15(24)23-22-13-10(18)6-9(17)7-11(13)19/h2-7,22H,1H3,(H,23,24).
What are the key properties of 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide?
4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide has a molecular weight of 413.72 g/mol, XLogP of 5.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-pyridin-2-yl-N'-(2,4,6-trichlorophenyl)-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 26720800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).