N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide

C17H11Cl2N3O2S — CID 49371200

IUPACN'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1cnc(-c2ccccc2Cl)s1
InChIInChI=1S/C17H11Cl2N3O2S/c18-12-7-3-1-5-10(12)15(23)21-22-16(24)14-9-20-17(25-14)11-6-2-4-8-13(11)19/h1-9H,(H,21,23)(H,22,24)
InChIKeyZLJJMBLMGVTXKM-UHFFFAOYSA-N
MW392.27 g/mol
LogP4.19
Rot. Bonds3

About N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide

N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide (PubChem CID 49371200) has the molecular formula C17H11Cl2N3O2S and a molecular weight of 392.27 g/mol. Its IUPAC name is N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide.

Molecular Properties

Compound NameN'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide
PubChem CID49371200
Molecular FormulaC17H11Cl2N3O2S
Molecular Weight392.27 g/mol
Exact Mass390.99
IUPAC NameN'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1cnc(-c2ccccc2Cl)s1
InChIInChI=1S/C17H11Cl2N3O2S/c18-12-7-3-1-5-10(12)15(23)21-22-16(24)14-9-20-17(25-14)11-6-2-4-8-13(11)19/h1-9H,(H,21,23)(H,22,24)
InChIKeyZLJJMBLMGVTXKM-UHFFFAOYSA-N
XLogP4.19
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.27
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2-chlorophenyl)-1,3-thiazol-5-yl]ethanone
CID 1477653
2-(2-chlorophenyl)-N-(2-methoxyethyl)-1,3-thiazole-5-carboxamide
CID 49371122
2-(2-chlorophenyl)-N'-methyl-N'-phenyl-1,3-thiazole-5-carbohydrazide
CID 51129260
N-(3-carbamoyl-4-methylphenyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carboxamide
CID 95172667
2-(2-chlorophenyl)-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]-1,3-thiazole-5-carboxamide
CID 56520770
2-(2-chlorophenyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-1,3-thiazole-5-carboxamide
CID 49372790
2-(2-chlorophenyl)-N-[4-(1,2,4-triazol-1-yl)phenyl]-1,3-thiazole-5-carboxamide
CID 49322472
2,6-dichloro-N'-(2-chlorobenzoyl)benzohydrazide
CID 78774908
N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-methyl-1,3-thiazole-5-carboxamide
CID 122134190
2-(2-chlorophenyl)-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]-1,3-thiazole-5-carboxamide
CID 49322069
2-(2-chlorophenyl)-N-[[(3S)-oxolan-3-yl]methylsulfonyl]-1,3-thiazole-5-carboxamide
CID 99704751
2-(2-chlorophenyl)-1,3-thiazol-5-amine
CID 96589915

Frequently Asked Questions

What is the IUPAC name of N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide?
The IUPAC name of N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide (CID 49371200) is N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide.
What is the SMILES notation for N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide?
The canonical SMILES for N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide is O=C(NNC(=O)c1ccccc1Cl)c1cnc(-c2ccccc2Cl)s1.
What is the InChIKey of N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide?
The InChIKey is ZLJJMBLMGVTXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2N3O2S/c18-12-7-3-1-5-10(12)15(23)21-22-16(24)14-9-20-17(25-14)11-6-2-4-8-13(11)19/h1-9H,(H,21,23)(H,22,24).
What are the key properties of N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide?
N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide has a molecular weight of 392.27 g/mol, XLogP of 4.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorobenzoyl)-2-(2-chlorophenyl)-1,3-thiazole-5-carbohydrazide is sourced from PubChem (CID 49371200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).