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

C11H10ClN3OS — CID 2315799

IUPACN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide
SMILESCC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C11H10ClN3OS/c1-7(16)14-15-11-13-10(6-17-11)8-2-4-9(12)5-3-8/h2-6H,1H3,(H,13,15)(H,14,16)
InChIKeyTWXVDWVRVZGUDD-UHFFFAOYSA-N
MW267.74 g/mol
LogP2.93
Rot. Bonds3

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

N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide (PubChem CID 2315799) has the molecular formula C11H10ClN3OS and a molecular weight of 267.74 g/mol. Its IUPAC name is N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide.

Molecular Properties

Compound NameN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide
PubChem CID2315799
Molecular FormulaC11H10ClN3OS
Molecular Weight267.74 g/mol
Exact Mass267.02
IUPAC NameN'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide
SMILESCC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C11H10ClN3OS/c1-7(16)14-15-11-13-10(6-17-11)8-2-4-9(12)5-3-8/h2-6H,1H3,(H,13,15)(H,14,16)
InChIKeyTWXVDWVRVZGUDD-UHFFFAOYSA-N
XLogP2.93
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.74
LogP ≤ 52.93
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

N'-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]acetohydrazide
CID 4174177
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-methoxybenzohydrazide
CID 1497726
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]nonanehydrazide
CID 2718859
4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 7923619
1-[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]phenyl]ethanone
CID 84564240
4-(4-chlorophenyl)-N-(propan-2-ylideneamino)-1,3-thiazol-2-amine
CID 17163601
2-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]acetic acid
CID 82134209
(Z)-4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]amino]-3-methyl-4-oxobut-2-enoic acid
CID 7223548
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-nitrobenzohydrazide;hydrobromide
CID 72698043
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carbohydrazide
CID 11740089
ethyl N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamate
CID 3624682
cis-(1S,2R)-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-methylcyclopropane-1-carboxamide
CID 8838993

Frequently Asked Questions

What is the IUPAC name of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide?
The IUPAC name of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide (CID 2315799) is N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide.
What is the SMILES notation for N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide?
The canonical SMILES for N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide is CC(=O)NNc1nc(-c2ccc(Cl)cc2)cs1.
What is the InChIKey of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide?
The InChIKey is TWXVDWVRVZGUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3OS/c1-7(16)14-15-11-13-10(6-17-11)8-2-4-9(12)5-3-8/h2-6H,1H3,(H,13,15)(H,14,16).
What are the key properties of N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide?
N'-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetohydrazide has a molecular weight of 267.74 g/mol, XLogP of 2.93, 3 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]acetohydrazide is sourced from PubChem (CID 2315799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).